3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C15H15N5S2 MolecularWeight: 329.4431

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2C3=CC=CC=C3)C

InChI

InChI=1S/C15H15N5S2/c1-10-8-11(2)17-14(16-10)22-9-13-18-19-15(21)20(13)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3,(H,19,21)