5-[(phenylmethylsulfanyl)methyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(phenylmethylsulfanyl)methyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(benzylsulfanylmethyl)-4-(4-isopropylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-[(phenylmethylthio)methyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(benzylsulfanylmethyl)-4-(4-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-[(benzylthio)methyl]-4-p-cumenyl-1,2,4-triazole-3-thiolate Formula: C19H20N3S2- MolecularWeight: 354.5122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NN=C2[S-])CSCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NN=C2[S-])CSCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3S2/c1-14(2)16-8-10-17(11-9-16)22-18(20-21-19(22)23)13-24-12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,21,23)/p-1