1-(phenylmethyl)-3-[3-[(phenylmethyl)carbamothioylamino]phenyl]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[3-[(phenylmethyl)carbamothioylamino]phenyl]thiourea Openeye Name: 1-benzyl-3-[3-(benzylcarbamothioylamino)phenyl]thiourea CAS Name: 1-(phenylmethyl)-3-[3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]phenyl]thiourea IUPAC Name: 1-benzyl-3-[3-(benzylcarbamothioylamino)phenyl]thiourea Traditional Name: 1-benzyl-3-[3-(benzylthiocarbamoylamino)phenyl]thiourea Formula: C22H22N4S2 MolecularWeight: 406.56688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC(=CC=C2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC(=CC=C2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C22H22N4S2/c27-21(23-15-17-8-3-1-4-9-17)25-19-12-7-13-20(14-19)26-22(28)24-16-18-10-5-2-6-11-18/h1-14H,15-16H2,(H2,23,25,27)(H2,24,26,28)