[2-[(3-cyano-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate

Systemtic Name: [2-[(3-cyano-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Openeye Name: [2-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl] 2,3-bis(p-tolyl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(4-methylphenyl)-6-quinoxalinecarboxylic acid [2-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyano-5-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(p-tolyl)quinoxaline-6-carboxylic acid [2-[(5-carbethoxy-3-cyano-4-methyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C34H28N4O5S MolecularWeight: 604.67492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)C#N)C

InChI

InChI=1S/C34H28N4O5S/c1-5-42-34(41)31-21(4)25(17-35)32(44-31)38-28(39)18-43-33(40)24-14-15-26-27(16-24)37-30(23-12-8-20(3)9-13-23)29(36-26)22-10-6-19(2)7-11-22/h6-16H,5,18H2,1-4H3,(H,38,39)