N2-(4-methylphenyl)-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-methylphenyl)-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(p-tolyl)-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-methylphenyl)-6-[(1,3,4-thiadiazol-2-ylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-methylphenyl)-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(1,3,4-thiadiazol-2-ylthio)methyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C13H13N7S2 MolecularWeight: 331.41922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CS3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CS3

InChI

InChI=1S/C13H13N7S2/c1-8-2-4-9(5-3-8)16-12-18-10(17-11(14)19-12)6-21-13-20-15-7-22-13/h2-5,7H,6H2,1H3,(H3,14,16,17,18,19)