3-(2-oxidanylidene-5-phenylazanyl-3H-benzimidazol-1-yl)propanenitrile

Systemtic Name: 3-(2-oxidanylidene-5-phenylazanyl-3H-benzimidazol-1-yl)propanenitrile Openeye Name: 3-(5-anilino-2-oxo-3H-benzimidazol-1-yl)propanenitrile CAS Name: 3-(5-anilino-2-oxo-3H-benzimidazol-1-yl)propanenitrile IUPAC Name: 3-(5-anilino-2-oxo-3H-benzimidazol-1-yl)propanenitrile Traditional Name: 3-(5-anilino-2-keto-3H-benzimidazol-1-yl)propionitrile Formula: C16H14N4O MolecularWeight: 278.30856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC3=C(C=C2)N(C(=O)N3)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC3=C(C=C2)N(C(=O)N3)CCC#N

InChI

InChI=1S/C16H14N4O/c17-9-4-10-20-15-8-7-13(11-14(15)19-16(20)21)18-12-5-2-1-3-6-12/h1-3,5-8,11,18H,4,10H2,(H,19,21)