3-(4-tert-butylphenyl)-4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-methylsulfanyl-4-(o-tolyl)-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-4-(2-methylphenyl)-5-(methylthio)-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-(methylthio)-4-(o-tolyl)-1,2,4-triazole Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SC)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SC)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C20H23N3S/c1-14-8-6-7-9-17(14)23-18(21-22-19(23)24-5)15-10-12-16(13-11-15)20(2,3)4/h6-13H,1-5H3