3-(cyclohexylmethylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-(cyclohexylmethylsulfanyl)-N-(p-tolyl)-1H-1,2,4-triazol-5-amine CAS Name: 3-(cyclohexylmethylthio)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(cyclohexylmethylsulfanyl)-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Traditional Name: [3-(cyclohexylmethylthio)-1H-1,2,4-triazol-5-yl]-(p-tolyl)amine Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NN2)SCC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NN2)SCC3CCCCC3

InChI

InChI=1S/C16H22N4S/c1-12-7-9-14(10-8-12)17-15-18-16(20-19-15)21-11-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H2,17,18,19,20)