N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-homoveratryl-4-keto-N-methyl-4-[4-(methylthio)phenyl]butyramide Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)CCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C22H27NO4S/c1-23(14-13-16-5-11-20(26-2)21(15-16)27-3)22(25)12-10-19(24)17-6-8-18(28-4)9-7-17/h5-9,11,15H,10,12-14H2,1-4H3