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

Systemtic Name: methyl 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-acetyl-2-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-2-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-(3-phthalimidopropanoylamino)thiophene-3-carboxylic acid methyl ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C

InChI

InChI=1S/C20H18N2O6S/c1-10-15(20(27)28-3)17(29-16(10)11(2)23)21-14(24)8-9-22-18(25)12-6-4-5-7-13(12)19(22)26/h4-7H,8-9H2,1-3H3,(H,21,24)