6-(phenylmethylsulfanyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(phenylmethylsulfanyl)pyrimidine-4,5-diamine Openeye Name: 6-benzylsulfanylpyrimidine-4,5-diamine CAS Name: 6-(phenylmethylthio)pyrimidine-4,5-diamine IUPAC Name: 6-benzylsulfanylpyrimidine-4,5-diamine Traditional Name: [4-amino-6-(benzylthio)pyrimidin-5-yl]amine Formula: C11H12N4S MolecularWeight: 232.30478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=NC(=C2N)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=NC(=C2N)N

InChI

InChI=1S/C11H12N4S/c12-9-10(13)14-7-15-11(9)16-6-8-4-2-1-3-5-8/h1-5,7H,6,12H2,(H2,13,14,15)