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

Systemtic Name: 4-azanyl-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1H-1,2,4-triazole-5-thione Formula: C9H12N6S2 MolecularWeight: 268.36178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2N)C

InChI

InChI=1S/C9H12N6S2/c1-5-3-6(2)12-8(11-5)17-4-7-13-14-9(16)15(7)10/h3H,4,10H2,1-2H3,(H,14,16)