N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-piperonyl-acetamide Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O3S/c1-13-8-20(22-16-5-3-2-4-15(13)16)26-11-19(23)21-10-14-6-7-17-18(9-14)25-12-24-17/h2-9H,10-12H2,1H3,(H,21,23)