methyl 3-[[3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[[3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 3-[[[3-(2,5-dioxo-1-pyrrolidinyl)phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(3-succinimidobenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C21H16N2O5S MolecularWeight: 408.42714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=CC=C3)N4C(=O)CCC4=O

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=CC=C3)N4C(=O)CCC4=O

InChI

InChI=1S/C21H16N2O5S/c1-28-21(27)19-18(14-7-2-3-8-15(14)29-19)22-20(26)12-5-4-6-13(11-12)23-16(24)9-10-17(23)25/h2-8,11H,9-10H2,1H3,(H,22,26)