N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: N-homoveratryl-2-[(2-keto-2-pyrrolidino-ethyl)thio]benzamide Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3)OC

InChI

InChI=1S/C23H28N2O4S/c1-28-19-10-9-17(15-20(19)29-2)11-12-24-23(27)18-7-3-4-8-21(18)30-16-22(26)25-13-5-6-14-25/h3-4,7-10,15H,5-6,11-14,16H2,1-2H3,(H,24,27)