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

Systemtic Name: 1-(4-methylphenyl)-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]cyclohexane-1-carboxamide Openeye Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1-(p-tolyl)cyclohexanecarboxamide CAS Name: 1-(4-methylphenyl)-N-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-1-(4-methylphenyl)cyclohexane-1-carboxamide Traditional Name: N-[[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-1-(p-tolyl)cyclohexanecarboxamide Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)NCC3=NN=C(N3C)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)NCC3=NN=C(N3C)SCC4=CC=CC=C4

InChI

InChI=1S/C25H30N4OS/c1-19-11-13-21(14-12-19)25(15-7-4-8-16-25)23(30)26-17-22-27-28-24(29(22)2)31-18-20-9-5-3-6-10-20/h3,5-6,9-14H,4,7-8,15-18H2,1-2H3,(H,26,30)