(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2,3-bis(p-tolyl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(4-methylphenyl)-6-quinoxalinecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(p-tolyl)quinoxaline-6-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C29H22N2O3S MolecularWeight: 478.56158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OCC(=O)C4=CC=CS4)N=C2C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OCC(=O)C4=CC=CS4)N=C2C5=CC=C(C=C5)C

InChI

InChI=1S/C29H22N2O3S/c1-18-5-9-20(10-6-18)27-28(21-11-7-19(2)8-12-21)31-24-16-22(13-14-23(24)30-27)29(33)34-17-25(32)26-4-3-15-35-26/h3-16H,17H2,1-2H3