(2R)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-piperidin-1-yl-propan-1-one

Systemtic Name: (2R)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-piperidin-1-yl-propan-1-one Openeye Name: (2R)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(1-piperidyl)propan-1-one CAS Name: (2R)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: (2R)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-piperidin-1-ylpropan-1-one Traditional Name: (2R)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-piperidino-propan-1-one Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NN=C(N2C)C3=CC=NC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NN=C(N2C)C3=CC=NC=C3

InChI

InChI=1S/C16H21N5OS/c1-12(15(22)21-10-4-3-5-11-21)23-16-19-18-14(20(16)2)13-6-8-17-9-7-13/h6-9,12H,3-5,10-11H2,1-2H3/t12-/m1/s1