N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide Openeye Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-[[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide IUPAC Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide Traditional Name: N-[[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)CNC(=O)C3CCCCC3

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)CNC(=O)C3CCCCC3

InChI

InChI=1S/C18H24N4OS/c1-24-18-21-20-16(22(18)13-14-8-4-2-5-9-14)12-19-17(23)15-10-6-3-7-11-15/h2,4-5,8-9,15H,3,6-7,10-13H2,1H3,(H,19,23)