4-(4-chlorophenyl)sulfanyl-N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-[2-(2,5-dimethylanilino)-2-oxo-ethyl]-N-methyl-butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylbutanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methylbutanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-[2-(2,5-dimethylanilino)-2-keto-ethyl]-N-methyl-butyramide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)CCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)CCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O2S/c1-15-6-7-16(2)19(13-15)23-20(25)14-24(3)21(26)5-4-12-27-18-10-8-17(22)9-11-18/h6-11,13H,4-5,12,14H2,1-3H3,(H,23,25)