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

Systemtic Name: N-[4-[1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-[2-(3-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-[[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[4-[[2-(3-chloro-2-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=CC=C1Cl)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC(C)(C)C

InChI

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