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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)NCC2=CC=CC=C2)N

Isomeric SMILES

CSC1=NC(=CC(=N1)NCC2=CC=CC=C2)N

InChI

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