methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1,3-dioxoisoindolin-2-yl)acetyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-phthalimidoacetyl)amino]benzothiophene-3-carboxylic acid methyl ester Formula: C20H14N2O5S MolecularWeight: 394.40056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H14N2O5S/c1-27-20(26)16-13-8-4-5-9-14(13)28-17(16)21-15(23)10-22-18(24)11-6-2-3-7-12(11)19(22)25/h2-9H,10H2,1H3,(H,21,23)