methyl 2-[2-[1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-3-oxidanylidene-2,4-dihydroquinoxalin-2-yl]ethanoylamino]-3-pyridin-4-yl-propanoate

Systemtic Name: methyl 2-[2-[1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-3-oxidanylidene-2,4-dihydroquinoxalin-2-yl]ethanoylamino]-3-pyridin-4-yl-propanoate Openeye Name: methyl 2-[[2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-(4-pyridyl)propanoate CAS Name: 2-[[2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-1-oxoethyl]amino]-3-pyridin-4-ylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-pyridin-4-ylpropanoate Traditional Name: 2-[[2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-keto-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-(4-pyridyl)propionic acid methyl ester Formula: C27H27ClN4O6S MolecularWeight: 571.04448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2C(C(=O)NC3=CC=CC=C32)CC(=O)NC(CC4=CC=NC=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2C(C(=O)NC3=CC=CC=C32)CC(=O)NC(CC4=CC=NC=C4)C(=O)OC

InChI

InChI=1S/C27H27ClN4O6S/c1-16-13-24(17(2)12-19(16)28)39(36,37)32-22-7-5-4-6-20(22)31-26(34)23(32)15-25(33)30-21(27(35)38-3)14-18-8-10-29-11-9-18/h4-13,21,23H,14-15H2,1-3H3,(H,30,33)(H,31,34)