1-[(4-chlorophenyl)methyl]-3-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiourea Traditional Name: 1-(4-chlorobenzyl)-3-[[2-phenyl-2-(phenylthio)acetyl]amino]thiourea Formula: C22H20ClN3OS2 MolecularWeight: 441.9967

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)SC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3OS2/c23-18-13-11-16(12-14-18)15-24-22(28)26-25-21(27)20(17-7-3-1-4-8-17)29-19-9-5-2-6-10-19/h1-14,20H,15H2,(H,25,27)(H2,24,26,28)