Free Chemical Databases
-
[Synonyms]
NSC86198
[Structure]
[ Properties Computed from Structure]
Molecular Weight 335.379461 [g/mol] Molecular Formula C14H30N3O4P XLogP 2.6 H-Bond Donor 0 H-Bond Acceptor 7 Rotatable Bond Count 13 Exact Mass 335.197393 MonoIsotopic Mass 335.197393 Topological Polar Surface Area 72.7 Heavy Atom Count 22 Formal Charge 0 Complexity 354 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 1 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 5-butoxy-1-dibutoxyphosphoryl-4,5-dihydrotriazole
Canonical SMILES: CCCCOC1CN=NN1P(=O)(OCCCC)OCCCC
InChI: InChI=1/C14H30N3O4P/c1-4-7-10-19-14-13-15-16-17(14)22(18,
20-11-8-5-2)21-12-9-6-3/h14H,4-13H2,1-3H3
Other Chemicals
- IUPAC Name: 1-propyl-2-sulfanyl-5,6-dihydropyrimidin-4-one,Canonical SMILES: CCCN1CCC(=O)N=C1S,InChI: InChI=1/
- N-p-Tosylpirrolidin,Maybridge1_001664,CBMicro_013255,NSC61572,ZINC00029134,Pyrrolidine, 1-[(4-methylphenyl)sul
- IUPAC Name: 2-(bis(2-hydroxyethyl)amino)ethanol; germane,Canonical SMILES: C(CO)N(CCO)CCO.[GeH4],InChI: InChI=
- NSC15231,94551-21-0,
- NSC123223
- IUPAC Name: (4-hydroxy-3-methylnaphthalen-1-yl)iminourea,Canonical SMILES: CC1=C(C2=CC=CC=C2C(=C1)N=NC(=O)N)O,
- BRN 1356344,LS-69497,Formamide, N-(2-((1,2,3,7,8,12b-hexahydrobenzo(6,7)cyclohept(1,2,3-de)isoquinolin-2-yl)ca
- NSC100752,ST5443770,15831-62-6,
- Oprea1_831127,NSC112660,IVK/1273660,7-Chloro-8-methyl-2-[4-chlorophenyl]cinchoninic acid,
- IUPAC Name: 2-[2-[(2-carboxyphenyl)diazenyl-sulfanylmethylidene]hydrazinyl]benzoic,acid,Canonical SMILES: C1=C
- Maybridge1_000416,CBDivE_002015,ZINC00066807,
- NSC112882
- IUPAC Name: 1-(4-methoxyphenyl)-3-(2-morpholin-4-ylethyl)-5H-2,3-benzodiazepin-4-one,Canonical SMILES: COC1=CC
- NSC139969
- NSC103407,16950-83-7,
- IUPAC Name: 1-(phenylmethylidene)indene,Canonical SMILES: C1=CC=C(C=C1)C=C2C=CC3=CC=CC=C32,InChI: InChI=1/C16H
- NSC32095,68641-73-6,
- S-Phenyl 2-furanthiocarboxylate,2-Furoic acid, thio-, S-phenyl ester,BRN 0132308,LS-70830,4-18-00-04002 (Beils
- NSC151234
- IUPAC Name: 1-[(2-methyl-9,9a-dihydro-4aH-pyrido[3,,4-b]indol-2-ium-1-yl)methyl]-3-propan-2-ylcyclopentan-1-ol
- MLS000547565,NSC159020,ZINC00481692,SMR000114648,AK-249/12982010,3-(4-methoxyphenyl)-4-methyl-1,3-thiazole-2(3
- Pyroxamine,Pyroxamine [INN],Pyroxaminum [INN-Latin],Piroxamina [INN-Spanish],C18H20ClNO,BRN 0260129,LS-137521,
- NSC157611
- N-(5-Nitro-2-furoyl)urea,LS-70104,N-(Aminocarbonyl)-5-nitro-2-furancarboxamide,2-Furancarboxamide, N-(aminocar
- IUPAC Name: 4-[4-(diaminomethylideneamino)sulfonylphenyl]diazenyl-3-,hydroxynaphthalene-2-carboxylic acid,Cano
- Eglumegad,Eglumegad [INN],LS-43724,LY354740 ,(1S,2S,5R,6S)-2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid,1
- 1,8-Naphthalene-1,2-benzimidazole,Benz(3,4)indolo(1,2-a)benzimidazole,BRN 0653624,LS-33469,20620-82-0,
- IUPAC Name: propan-2-yl,4-[2-(butyl-propan-2-yloxycarbonylamino)ethyl]piperazine-1-carboxylate,Canonical SMILE
- Eastozone 32,NSC56771,p-Phenylenediamine, N,N'-di-sec-butyl-N,N'-dimethyl-,1,4-Benzenediamine, N,N'