6-[2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylethanoyl]-4-methyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylethanoyl]-4-methyl-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]acetyl]-4-methyl-1,4-benzoxazin-3-one CAS Name: 6-[2-[(8-methoxy-4-methyl-2-quinolinyl)thio]-1-oxoethyl]-4-methyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(8-methoxy-4-methylquinolin-2-yl)sulfanylacetyl]-4-methyl-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(8-methoxy-4-methyl-2-quinolyl)thio]acetyl]-4-methyl-1,4-benzoxazin-3-one Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4C

InChI

InChI=1S/C22H20N2O4S/c1-13-9-20(23-22-15(13)5-4-6-19(22)27-3)29-12-17(25)14-7-8-18-16(10-14)24(2)21(26)11-28-18/h4-10H,11-12H2,1-3H3