[2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-keto-2-(3-methylbenzothiophen-2-yl)ethyl] ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)C3=CC(=CN3)C(=O)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)C3=CC(=CN3)C(=O)C

InChI

InChI=1S/C18H15NO4S/c1-10-13-5-3-4-6-16(13)24-17(10)15(21)9-23-18(22)14-7-12(8-19-14)11(2)20/h3-8,19H,9H2,1-2H3