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

Systemtic Name: 6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C8H12N8S MolecularWeight: 252.29948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC2=NC(=NC(=N2)N)N

Isomeric SMILES

CC1=NN=C(N1C)SCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C8H12N8S/c1-4-14-15-8(16(4)2)17-3-5-11-6(9)13-7(10)12-5/h3H2,1-2H3,(H4,9,10,11,12,13)