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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)N2CCC(CC2)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)N2CCC(CC2)C)C3=CC=NC=C3

InChI

InChI=1S/C18H25N5OS/c1-4-23-16(15-5-9-19-10-6-15)20-21-18(23)25-14(3)17(24)22-11-7-13(2)8-12-22/h5-6,9-10,13-14H,4,7-8,11-12H2,1-3H3/t14-/m1/s1