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

Systemtic Name: 1-[(2R)-2-methylpiperidin-1-yl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[(2R)-2-methyl-1-piperidyl]-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[(2R)-2-methyl-1-piperidinyl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-[(2R)-2-methylpiperidin-1-yl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[(2R)-2-methylpiperidino]-2-[[4-propyl-5-(4-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)N2CCCCC2C)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)N2CCCC[C@H]2C)C3=CC=NC=C3

InChI

InChI=1S/C18H25N5OS/c1-3-11-23-17(15-7-9-19-10-8-15)20-21-18(23)25-13-16(24)22-12-5-4-6-14(22)2/h7-10,14H,3-6,11-13H2,1-2H3/t14-/m1/s1