methyl 3-[2-[2-oxidanylidene-2-(propylamino)ethanoyl]pyrrol-1-yl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[2-oxidanylidene-2-(propylamino)ethanoyl]pyrrol-1-yl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[2-[2-oxo-2-(propylamino)acetyl]pyrrol-1-yl]benzothiophene-2-carboxylate CAS Name: 3-[2-[1,2-dioxo-2-(propylamino)ethyl]-1-pyrrolyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-[2-oxo-2-(propylamino)acetyl]pyrrol-1-yl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[2-[2-keto-2-(propylamino)acetyl]pyrrol-1-yl]benzothiophene-2-carboxylic acid methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(=O)C1=CC=CN1C2=C(SC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCCNC(=O)C(=O)C1=CC=CN1C2=C(SC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C19H18N2O4S/c1-3-10-20-18(23)16(22)13-8-6-11-21(13)15-12-7-4-5-9-14(12)26-17(15)19(24)25-2/h4-9,11H,3,10H2,1-2H3,(H,20,23)