1-[4-[2-(4-cyanophenyl)carbonylhydrazinyl]phenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4-[2-(4-cyanophenyl)carbonylhydrazinyl]phenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[2-(4-cyanobenzoyl)hydrazino]phenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[(4-cyanophenyl)-oxomethyl]hydrazo]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-[2-(4-cyanobenzoyl)hydrazinyl]phenyl]-3-phenylthiourea Traditional Name: 1-[4-[N'-(4-cyanobenzoyl)hydrazino]phenyl]-3-phenyl-thiourea Formula: C21H17N5OS MolecularWeight: 387.45758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NNC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17N5OS/c22-14-15-6-8-16(9-7-15)20(27)26-25-19-12-10-18(11-13-19)24-21(28)23-17-4-2-1-3-5-17/h1-13,25H,(H,26,27)(H2,23,24,28)