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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2CCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2CCC3=CC=CC=C3

InChI

InChI=1S/C20H23N3S/c1-20(2,3)17-11-9-16(10-12-17)18-21-22-19(24)23(18)14-13-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,22,24)