5-[(4-azanyl-3,5-dimethoxy-phenyl)methyl]-6-chloranyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[(4-azanyl-3,5-dimethoxy-phenyl)methyl]-6-chloranyl-pyrimidine-2,4-diamine Openeye Name: 5-[(4-amino-3,5-dimethoxy-phenyl)methyl]-6-chloro-pyrimidine-2,4-diamine CAS Name: 5-[(4-amino-3,5-dimethoxyphenyl)methyl]-6-chloropyrimidine-2,4-diamine IUPAC Name: 5-[(4-amino-3,5-dimethoxyphenyl)methyl]-6-chloropyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-amino-3,5-dimethoxy-benzyl)-6-chloro-pyrimidin-4-yl]amine Formula: C13H16ClN5O2 MolecularWeight: 309.75144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1N)OC)CC2=C(N=C(N=C2Cl)N)N

Isomeric SMILES

COC1=CC(=CC(=C1N)OC)CC2=C(N=C(N=C2Cl)N)N

InChI

InChI=1S/C13H16ClN5O2/c1-20-8-4-6(5-9(21-2)10(8)15)3-7-11(14)18-13(17)19-12(7)16/h4-5H,3,15H2,1-2H3,(H4,16,17,18,19)