N-(5-chloranyl-2-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(5-chloro-2-methylphenyl)acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C22H20ClN3OS2 MolecularWeight: 441.9967

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3OS2/c1-15-10-11-16(23)12-20(15)26-21(27)14-29-19-9-5-8-18(13-19)25-22(28)24-17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,26,27)(H2,24,25,28)