6-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C6H9N9S MolecularWeight: 239.26096

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=NC(=NC(=N1)N)N)SC2=NNC(=N2)N

Isomeric SMILES

C(C1=NC(=NC(=N1)N)N)SC2=NNC(=N2)N

InChI

InChI=1S/C6H9N9S/c7-3-10-2(11-4(8)12-3)1-16-6-13-5(9)14-15-6/h1H2,(H3,9,13,14,15)(H4,7,8,10,11,12)