1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]-N-phenyl-nipecotamide Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H31N5O2S/c29-21(16-31-23-25-20(26-27-23)13-12-17-7-4-5-8-17)28-14-6-9-18(15-28)22(30)24-19-10-2-1-3-11-19/h1-3,10-11,17-18H,4-9,12-16H2,(H,24,30)(H,25,26,27)