ethyl 6-[4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[1-oxo-3-(1,2,4-triazol-1-yl)propyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazino]nicotinic acid ethyl ester Formula: C17H22N6O3 MolecularWeight: 358.39498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)CCN3C=NC=N3

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)CCN3C=NC=N3

InChI

InChI=1S/C17H22N6O3/c1-2-26-17(25)14-3-4-15(19-11-14)21-7-9-22(10-8-21)16(24)5-6-23-13-18-12-20-23/h3-4,11-13H,2,5-10H2,1H3