phenyl N-cyano-N'-[4-(phenylmethyl)phenyl]carbamimidate

Systemtic Name: phenyl N-cyano-N'-[4-(phenylmethyl)phenyl]carbamimidate Openeye Name: 3-(4-benzylphenyl)-1-cyano-2-phenyl-isourea CAS Name: N-cyano-N'-[4-(phenylmethyl)phenyl]carbamimidic acid phenyl ester IUPAC Name: phenyl N'-(4-benzylphenyl)-N-cyanocarbamimidate Traditional Name: 3-(4-benzylphenyl)-1-cyano-2-phenyl-isourea Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)N=C(NC#N)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)N=C(NC#N)OC3=CC=CC=C3

InChI

InChI=1S/C21H17N3O/c22-16-23-21(25-20-9-5-2-6-10-20)24-19-13-11-18(12-14-19)15-17-7-3-1-4-8-17/h1-14H,15H2,(H,23,24)