1-(3-cyanophenyl)-3-[2-(phenylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-(3-cyanophenyl)-3-[2-(phenylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-(2-benzylsulfanylethyl)-3-(3-cyanophenyl)thiourea CAS Name: 1-(3-cyanophenyl)-3-[2-(phenylmethylthio)ethyl]thiourea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-(3-cyanophenyl)thiourea Traditional Name: 1-[2-(benzylthio)ethyl]-3-(3-cyanophenyl)thiourea Formula: C17H17N3S2 MolecularWeight: 327.46698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=S)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=S)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H17N3S2/c18-12-15-7-4-8-16(11-15)20-17(21)19-9-10-22-13-14-5-2-1-3-6-14/h1-8,11H,9-10,13H2,(H2,19,20,21)