N-propyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)piperidine-1-carboxamide

Systemtic Name: N-propyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)piperidine-1-carboxamide Openeye Name: N-propyl-4-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]piperidine-1-carboxamide CAS Name: N-propyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)-1-piperidinecarboxamide IUPAC Name: N-propyl-4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)piperidine-1-carboxamide Traditional Name: N-propyl-4-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]piperidine-1-carboxamide Formula: C16H22N6O MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCC(CC1)C2=NC(=NN2)C3=CC=NC=C3

Isomeric SMILES

CCCNC(=O)N1CCC(CC1)C2=NC(=NN2)C3=CC=NC=C3

InChI

InChI=1S/C16H22N6O/c1-2-7-18-16(23)22-10-5-13(6-11-22)15-19-14(20-21-15)12-3-8-17-9-4-12/h3-4,8-9,13H,2,5-7,10-11H2,1H3,(H,18,23)(H,19,20,21)