methyl 5-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-3-ethoxy-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-3-ethoxy-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]-3-ethoxy-benzothiophene-2-carboxylate CAS Name: 5-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-3-ethoxy-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]-3-ethoxy-1-benzothiophene-2-carboxylate Traditional Name: 3-ethoxy-5-(4-phthalimidobutanoylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C24H22N2O6S MolecularWeight: 466.50628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC2=C1C=C(C=C2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)OC

Isomeric SMILES

CCOC1=C(SC2=C1C=C(C=C2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)OC

InChI

InChI=1S/C24H22N2O6S/c1-3-32-20-17-13-14(10-11-18(17)33-21(20)24(30)31-2)25-19(27)9-6-12-26-22(28)15-7-4-5-8-16(15)23(26)29/h4-5,7-8,10-11,13H,3,6,9,12H2,1-2H3,(H,25,27)