6,7,8-trimethoxy-2-[2-(phenylmethylsulfanyl)phenyl]-1H-quinolin-4-one

Systemtic Name: 6,7,8-trimethoxy-2-[2-(phenylmethylsulfanyl)phenyl]-1H-quinolin-4-one Openeye Name: 2-(2-benzylsulfanylphenyl)-6,7,8-trimethoxy-1H-quinolin-4-one CAS Name: 6,7,8-trimethoxy-2-[2-(phenylmethylthio)phenyl]-1H-quinolin-4-one IUPAC Name: 2-(2-benzylsulfanylphenyl)-6,7,8-trimethoxy-1H-quinolin-4-one Traditional Name: 2-[2-(benzylthio)phenyl]-6,7,8-trimethoxy-4-quinolone Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=O)C=C(N2)C3=CC=CC=C3SCC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=O)C=C(N2)C3=CC=CC=C3SCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H23NO4S/c1-28-21-13-18-20(27)14-19(26-23(18)25(30-3)24(21)29-2)17-11-7-8-12-22(17)31-15-16-9-5-4-6-10-16/h4-14H,15H2,1-3H3,(H,26,27)