N-(1,3-benzodioxol-5-yl)-2-(7-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(7-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(7-methoxy-3-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(7-methoxy-3-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(7-methoxy-3-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(7-methoxy-3-methyl-2-quinolyl)thio]acetamide Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=C(C=CC2=C1)OC)SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(N=C2C=C(C=CC2=C1)OC)SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O4S/c1-12-7-13-3-5-15(24-2)9-16(13)22-20(12)27-10-19(23)21-14-4-6-17-18(8-14)26-11-25-17/h3-9H,10-11H2,1-2H3,(H,21,23)