(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-piperidino-ethanone Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1S[C@H](C2=CC=CC=C2)C(=O)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS/c1-25-20(18-13-7-3-8-14-18)23-24-22(25)28-19(17-11-5-2-6-12-17)21(27)26-15-9-4-10-16-26/h2-3,5-8,11-14,19H,4,9-10,15-16H2,1H3/t19-/m1/s1