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

Systemtic Name: 3-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(4,6-diaminopyrimidin-2-yl)thio]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C8H11N7S2 MolecularWeight: 269.34984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CN1C(=NNC1=S)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C8H11N7S2/c1-15-6(13-14-8(15)16)3-17-7-11-4(9)2-5(10)12-7/h2H,3H2,1H3,(H,14,16)(H4,9,10,11,12)