[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 3-pyrrol-1-ylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 3-pyrrol-1-ylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC(=O)NCCC3=CC=CS3

Isomeric SMILES

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C19H18N2O3S/c22-18(20-9-8-17-7-4-12-25-17)14-24-19(23)15-5-3-6-16(13-15)21-10-1-2-11-21/h1-7,10-13H,8-9,14H2,(H,20,22)