N-[1-(cyanomethylamino)-3-[(3,4-dichlorophenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: N-[1-(cyanomethylamino)-3-[(3,4-dichlorophenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: N-[2-(cyanomethylamino)-1-[(3,4-dichlorophenyl)methylsulfanylmethyl]-2-oxo-ethyl]benzamide CAS Name: N-[1-(cyanomethylamino)-3-[(3,4-dichlorophenyl)methylthio]-1-oxopropan-2-yl]benzamide IUPAC Name: N-[1-(cyanomethylamino)-3-[(3,4-dichlorophenyl)methylsulfanyl]-1-oxopropan-2-yl]benzamide Traditional Name: N-[2-(cyanomethylamino)-1-[[(3,4-dichlorobenzyl)thio]methyl]-2-keto-ethyl]benzamide Formula: C19H17Cl2N3O2S MolecularWeight: 422.32818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)NCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)NCC#N

InChI

InChI=1S/C19H17Cl2N3O2S/c20-15-7-6-13(10-16(15)21)11-27-12-17(19(26)23-9-8-22)24-18(25)14-4-2-1-3-5-14/h1-7,10,17H,9,11-12H2,(H,23,26)(H,24,25)