N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-(dimethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-homoveratryl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-23(2)20(24)14-28-19-8-6-5-7-16(19)21(25)22-12-11-15-9-10-17(26-3)18(13-15)27-4/h5-10,13H,11-12,14H2,1-4H3,(H,22,25)