3-[(2-methylphenyl)methylsulfanylmethyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-methylphenyl)methylsulfanylmethyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-isopropylphenyl)-3-(o-tolylmethylsulfanylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(2-methylphenyl)methylthio]methyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-methylphenyl)methylsulfanylmethyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(2-methylbenzyl)thio]methyl]-4-p-cumenyl-1H-1,2,4-triazole-5-thione Formula: C20H23N3S2 MolecularWeight: 369.54672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC2=NNC(=S)N2C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=CC=C1CSCC2=NNC(=S)N2C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C20H23N3S2/c1-14(2)16-8-10-18(11-9-16)23-19(21-22-20(23)24)13-25-12-17-7-5-4-6-15(17)3/h4-11,14H,12-13H2,1-3H3,(H,22,24)