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

Systemtic Name: 1-(2-methylpiperidin-1-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2-methyl-1-piperidyl)-2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(2-methyl-1-piperidinyl)-2-[[4-methyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(2-methylpiperidin-1-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2-methylpiperidino)-2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NN=C(N2C)C3=CN=CC=C3

Isomeric SMILES

CC1CCCCN1C(=O)CSC2=NN=C(N2C)C3=CN=CC=C3

InChI

InChI=1S/C16H21N5OS/c1-12-6-3-4-9-21(12)14(22)11-23-16-19-18-15(20(16)2)13-7-5-8-17-10-13/h5,7-8,10,12H,3-4,6,9,11H2,1-2H3