ethyl 6,7-dimethyl-3-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 6,7-dimethyl-3-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-[4-(1,1-dimethylpropyl)phenyl]sulfonylpiperazin-1-yl]-6,7-dimethyl-quinoxaline-2-carboxylate CAS Name: 6,7-dimethyl-3-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-1-piperazinyl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dimethyl-3-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-(4-tert-amylphenyl)sulfonylpiperazino]-6,7-dimethyl-quinoxaline-2-carboxylic acid ethyl ester Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(C=C(C(=C4)C)C)N=C3C(=O)OCC

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(C=C(C(=C4)C)C)N=C3C(=O)OCC

InChI

InChI=1S/C28H36N4O4S/c1-7-28(5,6)21-9-11-22(12-10-21)37(34,35)32-15-13-31(14-16-32)26-25(27(33)36-8-2)29-23-17-19(3)20(4)18-24(23)30-26/h9-12,17-18H,7-8,13-16H2,1-6H3