[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-[4-(4-methoxyphenyl)-3-oxidanylidene-quinoxalin-2-yl]propanoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3-[4-(4-methoxyphenyl)-3-oxidanylidene-quinoxalin-2-yl]propanoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 3-[4-(4-methoxyphenyl)-3-oxo-quinoxalin-2-yl]propanoate CAS Name: 3-[4-(4-methoxyphenyl)-3-oxo-2-quinoxalinyl]propanoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 3-[4-(4-methoxyphenyl)-3-oxoquinoxalin-2-yl]propanoate Traditional Name: 3-[3-keto-4-(4-methoxyphenyl)quinoxalin-2-yl]propionic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C(C2=O)CCC(=O)OCC(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C(C2=O)CCC(=O)OCC(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C27H24N2O5S/c1-33-20-11-9-19(10-12-20)29-24-6-4-3-5-22(24)28-23(27(29)32)15-16-26(31)34-17-25(30)18-7-13-21(35-2)14-8-18/h3-14H,15-17H2,1-2H3