[4-(thiophen-2-ylcarbonylamino)phenyl] 2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(o-tolyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-methylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(2-methylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(o-tolyl)isoindoline-5-carboxylic acid [4-(2-thenoylamino)phenyl] ester Formula: C27H18N2O5S MolecularWeight: 482.50722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=C(C=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC=C(C=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C27H18N2O5S/c1-16-5-2-3-6-22(16)29-25(31)20-13-8-17(15-21(20)26(29)32)27(33)34-19-11-9-18(10-12-19)28-24(30)23-7-4-14-35-23/h2-15H,1H3,(H,28,30)