2-phenethylsulfanylpyrimidine-4,6-diamine

Systemtic Name: 2-phenethylsulfanylpyrimidine-4,6-diamine Openeye Name: 2-phenethylsulfanylpyrimidine-4,6-diamine CAS Name: 2-(phenethylthio)pyrimidine-4,6-diamine IUPAC Name: 2-phenethylsulfanylpyrimidine-4,6-diamine Traditional Name: [6-amino-2-(phenethylthio)pyrimidin-4-yl]amine Formula: C12H14N4S MolecularWeight: 246.33136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C12H14N4S/c13-10-8-11(14)16-12(15-10)17-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H4,13,14,15,16)