N-[4-(2-chlorophenyl)sulfanyl-1-[cyano(methyl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-(2-chlorophenyl)sulfanyl-1-[cyano(methyl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[3-(2-chlorophenyl)sulfanyl-1-[cyano(methyl)carbamoyl]propyl]benzamide CAS Name: N-[4-[(2-chlorophenyl)thio]-1-[cyano(methyl)amino]-1-oxobutan-2-yl]benzamide IUPAC Name: N-[4-(2-chlorophenyl)sulfanyl-1-[cyano(methyl)amino]-1-oxobutan-2-yl]benzamide Traditional Name: N-[3-[(2-chlorophenyl)thio]-1-[cyano(methyl)carbamoyl]propyl]benzamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C#N)C(=O)C(CCSC1=CC=CC=C1Cl)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C#N)C(=O)C(CCSC1=CC=CC=C1Cl)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H18ClN3O2S/c1-23(13-21)19(25)16(22-18(24)14-7-3-2-4-8-14)11-12-26-17-10-6-5-9-15(17)20/h2-10,16H,11-12H2,1H3,(H,22,24)