2-[1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-3-oxidanylidene-2,4-dihydroquinoxalin-2-yl]-N-(4-pyridin-2-ylbut-3-ynyl)ethanamide

Systemtic Name: 2-[1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-3-oxidanylidene-2,4-dihydroquinoxalin-2-yl]-N-(4-pyridin-2-ylbut-3-ynyl)ethanamide Openeye Name: 2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-N-[4-(2-pyridyl)but-3-ynyl]acetamide CAS Name: 2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-N-[4-(2-pyridinyl)but-3-ynyl]acetamide IUPAC Name: 2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-N-(4-pyridin-2-ylbut-3-ynyl)acetamide Traditional Name: 2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-keto-2,4-dihydroquinoxalin-2-yl]-N-[4-(2-pyridyl)but-3-ynyl]acetamide Formula: C27H25ClN4O4S MolecularWeight: 537.0298

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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)NCCC#CC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2C(C(=O)NC3=CC=CC=C32)CC(=O)NCCC#CC4=CC=CC=N4

InChI

InChI=1S/C27H25ClN4O4S/c1-18-16-25(19(2)15-21(18)28)37(35,36)32-23-12-4-3-11-22(23)31-27(34)24(32)17-26(33)30-14-8-6-10-20-9-5-7-13-29-20/h3-5,7,9,11-13,15-16,24H,8,14,17H2,1-2H3,(H,30,33)(H,31,34)