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

Systemtic Name: (2R)-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: (2R)-2-phenyl-2-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: (2R)-2-[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: (2R)-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: (2R)-2-phenyl-2-[[5-piperidino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)N)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2S[C@H](C3=CC=CC=C3)C(=O)N)N4CCCCC4

InChI

InChI=1S/C22H25N5OS/c1-16-10-12-18(13-11-16)27-21(26-14-6-3-7-15-26)24-25-22(27)29-19(20(23)28)17-8-4-2-5-9-17/h2,4-5,8-13,19H,3,6-7,14-15H2,1H3,(H2,23,28)/t19-/m1/s1