N5-(3-methylphenyl)-2-methylsulfanyl-pyrimidine-4,5,6-triamine

Systemtic Name: N5-(3-methylphenyl)-2-methylsulfanyl-pyrimidine-4,5,6-triamine Openeye Name: 2-methylsulfanyl-N5-(m-tolyl)pyrimidine-4,5,6-triamine CAS Name: N5-(3-methylphenyl)-2-(methylthio)pyrimidine-4,5,6-triamine IUPAC Name: 5-N-(3-methylphenyl)-2-methylsulfanylpyrimidine-4,5,6-triamine Traditional Name: [4,6-diamino-2-(methylthio)pyrimidin-5-yl]-(m-tolyl)amine Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(N=C(N=C2N)SC)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(N=C(N=C2N)SC)N

InChI

InChI=1S/C12H15N5S/c1-7-4-3-5-8(6-7)15-9-10(13)16-12(18-2)17-11(9)14/h3-6,15H,1-2H3,(H4,13,14,16,17)