6-methylsulfanyl-N4-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 6-methylsulfanyl-N4-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N4-benzyl-6-methylsulfanyl-pyrimidine-2,4-diamine CAS Name: 6-(methylthio)-N4-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-benzyl-6-methylsulfanylpyrimidine-2,4-diamine Traditional Name: [2-amino-6-(methylthio)pyrimidin-4-yl]-benzyl-amine Formula: C12H14N4S MolecularWeight: 246.33136

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1)NCC2=CC=CC=C2)N

Isomeric SMILES

CSC1=NC(=NC(=C1)NCC2=CC=CC=C2)N

InChI

InChI=1S/C12H14N4S/c1-17-11-7-10(15-12(13)16-11)14-8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H3,13,14,15,16)