N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-N-piperonyl-benzamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4S/c24-20(23-9-3-4-10-23)13-28-19-6-2-1-5-16(19)21(25)22-12-15-7-8-17-18(11-15)27-14-26-17/h1-2,5-8,11H,3-4,9-10,12-14H2,(H,22,25)