5-[(3-methoxy-4-methylsulfanyl-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(3-methoxy-4-methylsulfanyl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3-methoxy-4-methylsulfanyl-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-methoxy-4-(methylthio)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3-methoxy-4-methylsulfanylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-methoxy-4-(methylthio)benzyl]pyrimidin-4-yl]amine Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)SC

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)SC

InChI

InChI=1S/C13H16N4OS/c1-18-10-6-8(3-4-11(10)19-2)5-9-7-16-13(15)17-12(9)14/h3-4,6-7H,5H2,1-2H3,(H4,14,15,16,17)