1-(4-chlorophenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(4-chlorophenyl)thiourea CAS Name: 1-(4-chlorophenyl)-3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]thiourea IUPAC Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(4-chlorophenyl)thiourea Traditional Name: 1-[[2-(benzylthio)acetyl]amino]-3-(4-chlorophenyl)thiourea Formula: C16H16ClN3OS2 MolecularWeight: 365.90074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClN3OS2/c17-13-6-8-14(9-7-13)18-16(22)20-19-15(21)11-23-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,21)(H2,18,20,22)