methyl 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-4-phenyl-2-(6-phthalimidohexanoylamino)thiophene-3-carboxylic acid methyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC)C4=CC=CC=C4

InChI

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