4-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O3S/c1-32-18-11-12-19-20(17-7-3-2-4-8-17)14-25(28-22(19)13-18)33-16-26(31)29-15-24(30)27-21-9-5-6-10-23(21)29/h2-14H,15-16H2,1H3,(H,27,30)