N-[4-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[4-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-[[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[4-[[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C28H31ClN2O3S MolecularWeight: 511.07534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)CC(C)(C)C

InChI

InChI=1S/C28H31ClN2O3S/c1-18-15-23(24(34-5)16-22(18)29)31-27(33)26(19-9-7-6-8-10-19)35-21-13-11-20(12-14-21)30-25(32)17-28(2,3)4/h6-16,26H,17H2,1-5H3,(H,30,32)(H,31,33)