3-cyclohexyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-cyclohexyl-4-(m-tolyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclohexyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-cyclohexyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-cyclohexyl-5-[(4-methylbenzyl)thio]-4-(m-tolyl)-1,2,4-triazole Formula: C23H27N3S MolecularWeight: 377.54558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4CCCCC4

InChI

InChI=1S/C23H27N3S/c1-17-11-13-19(14-12-17)16-27-23-25-24-22(20-8-4-3-5-9-20)26(23)21-10-6-7-18(2)15-21/h6-7,10-15,20H,3-5,8-9,16H2,1-2H3