3,3-dimethyl-N-[3-[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide

Systemtic Name: 3,3-dimethyl-N-[3-[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide Openeye Name: 3,3-dimethyl-N-[3-[1-methyl-2-(3-methylanilino)-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: 3,3-dimethyl-N-[3-[[1-(3-methylanilino)-1-oxopropan-2-yl]thio]phenyl]butanamide IUPAC Name: 3,3-dimethyl-N-[3-[1-(3-methylanilino)-1-oxopropan-2-yl]sulfanylphenyl]butanamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(m-toluidino)ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O2S/c1-15-8-6-9-17(12-15)24-21(26)16(2)27-19-11-7-10-18(13-19)23-20(25)14-22(3,4)5/h6-13,16H,14H2,1-5H3,(H,23,25)(H,24,26)