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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-methoxy-3-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-methoxy-3-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)thio]acetamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H20N2O4S/c1-13-9-14-10-16(25-2)4-5-17(14)23-21(13)28-12-20(24)22-15-3-6-18-19(11-15)27-8-7-26-18/h3-6,9-11H,7-8,12H2,1-2H3,(H,22,24)