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

Systemtic Name: 1-(3-methylpiperidin-1-yl)-2-[(4-propyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(3-methyl-1-piperidyl)-2-[[4-propyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(3-methyl-1-piperidinyl)-2-[[4-propyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(3-methylpiperidin-1-yl)-2-[(4-propyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(3-methylpiperidino)-2-[[4-propyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)N2CCCC(C2)C)C3=CN=CC=C3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)N2CCCC(C2)C)C3=CN=CC=C3

InChI

InChI=1S/C18H25N5OS/c1-3-9-23-17(15-7-4-8-19-11-15)20-21-18(23)25-13-16(24)22-10-5-6-14(2)12-22/h4,7-8,11,14H,3,5-6,9-10,12-13H2,1-2H3