ethyl 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 5-phenyl-2-(6-phthalimidohexanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H26N2O5S/c1-2-34-27(33)21-17-22(18-11-5-3-6-12-18)35-24(21)28-23(30)15-7-4-10-16-29-25(31)19-13-8-9-14-20(19)26(29)32/h3,5-6,8-9,11-14,17H,2,4,7,10,15-16H2,1H3,(H,28,30)