6-[(2-methylphenyl)methylsulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(2-methylphenyl)methylsulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-(o-tolylmethylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(2-methylphenyl)methylthio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(2-methylphenyl)methylsulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(2-methylbenzyl)thio]methyl]-s-triazin-2-yl]amine Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC2=NC(=NC(=N2)N)N

Isomeric SMILES

CC1=CC=CC=C1CSCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C12H15N5S/c1-8-4-2-3-5-9(8)6-18-7-10-15-11(13)17-12(14)16-10/h2-5H,6-7H2,1H3,(H4,13,14,15,16,17)