1-piperidin-1-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-piperidin-1-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(1-piperidyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1-piperidinyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-piperidin-1-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-piperidino-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C14H17N5OS MolecularWeight: 303.38268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NNC(=N2)C3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NNC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C14H17N5OS/c20-12(19-8-2-1-3-9-19)10-21-14-16-13(17-18-14)11-4-6-15-7-5-11/h4-7H,1-3,8-10H2,(H,16,17,18)