3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-tert-butylphenyl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NNC2=S)C3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NNC2=S)C3=CC=C(C=C3)C(C)(C)C)C

InChI

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