[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] 2-azanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl] 2-azanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] 2-aminopyridine-3-carboxylate CAS Name: 2-amino-3-pyridinecarboxylic acid [2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl] 2-aminopyridine-3-carboxylate Traditional Name: 2-aminonicotinic acid [2-keto-2-[4-(2-thenoyl)piperazino]ethyl] ester Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)C2=C(N=CC=C2)N)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)C2=C(N=CC=C2)N)C(=O)C3=CC=CS3

InChI

InChI=1S/C17H18N4O4S/c18-15-12(3-1-5-19-15)17(24)25-11-14(22)20-6-8-21(9-7-20)16(23)13-4-2-10-26-13/h1-5,10H,6-9,11H2,(H2,18,19)