N-(1,3-benzodioxol-5-yl)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(6-methoxy-2-methyl-4-quinolyl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(6-methoxy-2-methyl-4-quinolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(6-methoxy-2-methylquinolin-4-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(6-methoxy-2-methyl-4-quinolyl)thio]acetamide Formula: C20H18N2O4S MolecularWeight: 382.43292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

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