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

Systemtic Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-propan-1-one Openeye Name: (2R)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(1-piperidyl)propan-1-one CAS Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-ylpropan-1-one Traditional Name: (2R)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-1-piperidino-propan-1-one Formula: C19H26N4OS MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)N2CCCCC2)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)N2CCCCC2)C3=CC=CC=C3C

InChI

InChI=1S/C19H26N4OS/c1-4-23-17(16-11-7-6-10-14(16)2)20-21-19(23)25-15(3)18(24)22-12-8-5-9-13-22/h6-7,10-11,15H,4-5,8-9,12-13H2,1-3H3/t15-/m1/s1