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

Systemtic Name: 5-[(3,4-dimethoxy-5-methylsulfanyl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3,4-dimethoxy-5-methylsulfanyl-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,4-dimethoxy-5-(methylthio)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3,4-dimethoxy-5-methylsulfanylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,4-dimethoxy-5-(methylthio)benzyl]pyrimidin-4-yl]amine Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O2S/c1-19-10-5-8(6-11(21-3)12(10)20-2)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)