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

Systemtic Name: (2R)-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2R)-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2R)-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2R)-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2R)-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]-2-phenyl-1-piperidino-ethanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SC(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)S[C@H](C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C23H26N4OS/c1-2-17-11-13-19(14-12-17)21-24-23(26-25-21)29-20(18-9-5-3-6-10-18)22(28)27-15-7-4-8-16-27/h3,5-6,9-14,20H,2,4,7-8,15-16H2,1H3,(H,24,25,26)/t20-/m1/s1