N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-phenyl-cyclopentane-1-carboxamide

Systemtic Name: N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1-phenyl-cyclopentane-1-carboxamide Openeye Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-cyclopentanecarboxamide CAS Name: N-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]-1-phenyl-1-cyclopentanecarboxamide IUPAC Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1-phenylcyclopentane-1-carboxamide Traditional Name: N-[[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-1-phenyl-cyclopentanecarboxamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)CNC(=O)C3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)CNC(=O)C3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-27-20(25-26-22(27)29-17-18-10-4-2-5-11-18)16-24-21(28)23(14-8-9-15-23)19-12-6-3-7-13-19/h2-7,10-13H,8-9,14-17H2,1H3,(H,24,28)