2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methyl-5-quinoxalin-2-yl-phenyl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methyl-5-quinoxalin-2-yl-phenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(2-methyl-5-quinoxalin-2-yl-phenyl)-4-methylsulfonyl-butanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[2-methyl-5-(2-quinoxalinyl)phenyl]-4-methylsulfonylbutanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-methyl-5-quinoxalin-2-ylphenyl)-4-methylsulfonylbutanamide Traditional Name: 4-mesyl-N-(2-methyl-5-quinoxalin-2-yl-phenyl)-2-phthalimido-butyramide Formula: C28H24N4O5S MolecularWeight: 528.57896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N=C2)NC(=O)C(CCS(=O)(=O)C)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N=C2)NC(=O)C(CCS(=O)(=O)C)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H24N4O5S/c1-17-11-12-18(24-16-29-21-9-5-6-10-22(21)30-24)15-23(17)31-26(33)25(13-14-38(2,36)37)32-27(34)19-7-3-4-8-20(19)28(32)35/h3-12,15-16,25H,13-14H2,1-2H3,(H,31,33)