Free Chemical Databases
-
[Synonyms]
[Structure]
[ Properties Computed from Structure]
Molecular Weight 304.30124 [g/mol] Molecular Formula C14H16N4O4 XLogP -0.4 H-Bond Donor 2 H-Bond Acceptor 4 Rotatable Bond Count 4 Tautomer Count 3 Exact Mass 304.117155 MonoIsotopic Mass 304.117155 Topological Polar Surface Area 119 Heavy Atom Count 22 Formal Charge 0 Complexity 416 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 1 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 1-[2-[carbamoyl-(2-methylfuran-3-yl)amino]ethenyl]-1-(2-methylfuran-3-
yl)urea
Canonical SMILES: CC1=C(C=CO1)N(C=CN(C2=C(OC=C2)C)C(=O)N)C(=O)N
InChI: InChI=1/C14H16N4O4/c1-9-11(3-7-21-9)17(13(15)19)5-6-18(14(16)20)12-4-8-
22-10(12)2/h3-8H,1-2H3,(H2,15,19)(H2,16,20)/f/h15-16H2
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