N-[3-[1-[(3-chloranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[3-[1-[(3-chloranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[3-[2-(3-chloro-4-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[3-[[1-(3-chloro-4-methylanilino)-1-oxopropan-2-yl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[3-[1-(3-chloro-4-methylanilino)-1-oxopropan-2-yl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[3-[[2-(3-chloro-4-methyl-anilino)-2-keto-1-methyl-ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C22H27ClN2O2S MolecularWeight: 418.97998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)CC(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)CC(C)(C)C)Cl

InChI

InChI=1S/C22H27ClN2O2S/c1-14-9-10-17(12-19(14)23)25-21(27)15(2)28-18-8-6-7-16(11-18)24-20(26)13-22(3,4)5/h6-12,15H,13H2,1-5H3,(H,24,26)(H,25,27)