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

Systemtic Name: methyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-(4-phthalimidobutanoylamino)-4-(2-thienyl)thiophene-3-carboxylic acid methyl ester Formula: C22H18N2O5S2 MolecularWeight: 454.51872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H18N2O5S2/c1-29-22(28)18-15(16-8-5-11-30-16)12-31-19(18)23-17(25)9-4-10-24-20(26)13-6-2-3-7-14(13)21(24)27/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,23,25)