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

Systemtic Name: 2-[2-[1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-3-oxidanylidene-2,4-dihydroquinoxalin-2-yl]ethanoylamino]-3-phenyl-propanamide Openeye Name: 2-[[2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-phenyl-propanamide CAS Name: 2-[[2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-1-oxoethyl]amino]-3-phenylpropanamide IUPAC Name: 2-[[2-[1-(4-chloro-2,5-dimethylphenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-phenylpropanamide Traditional Name: 2-[[2-[1-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-3-keto-2,4-dihydroquinoxalin-2-yl]acetyl]amino]-3-phenyl-propionamide Formula: C27H27ClN4O5S MolecularWeight: 555.04508

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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=CC=C4)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C27H27ClN4O5S/c1-16-13-24(17(2)12-19(16)28)38(36,37)32-22-11-7-6-10-20(22)31-27(35)23(32)15-25(33)30-21(26(29)34)14-18-8-4-3-5-9-18/h3-13,21,23H,14-15H2,1-2H3,(H2,29,34)(H,30,33)(H,31,35)