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

Systemtic Name: N-[4-[1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-[2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-[[1-(2-methoxyanilino)-1-oxopropan-2-yl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-[1-(2-methoxyanilino)-1-oxopropan-2-yl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[4-[[2-keto-1-methyl-2-(o-anisidino)ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)SC2=CC=C(C=C2)NC(=O)CC(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1OC)SC2=CC=C(C=C2)NC(=O)CC(C)(C)C

InChI

InChI=1S/C22H28N2O3S/c1-15(21(26)24-18-8-6-7-9-19(18)27-5)28-17-12-10-16(11-13-17)23-20(25)14-22(2,3)4/h6-13,15H,14H2,1-5H3,(H,23,25)(H,24,26)