ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-(4-phthalimidobutanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22N2O6S/c1-4-30-22(29)17-12(2)18(13(3)25)31-19(17)23-16(26)10-7-11-24-20(27)14-8-5-6-9-15(14)21(24)28/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,23,26)