[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C20H18N2O3S/c23-19(21-15-8-9-15)17(14-6-2-1-3-7-14)25-20(24)18-16(10-13-26-18)22-11-4-5-12-22/h1-7,10-13,15,17H,8-9H2,(H,21,23)