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

Systemtic Name: 5-[(3,4-dimethoxy-5-pyridin-3-yl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,4-dimethoxy-5-(3-pyridyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,4-dimethoxy-5-(3-pyridinyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3,4-dimethoxy-5-pyridin-3-ylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,4-dimethoxy-5-(3-pyridyl)benzyl]pyrimidin-4-yl]amine Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CN=CC=C3)OC

InChI

InChI=1S/C18H19N5O2/c1-24-15-8-11(6-13-10-22-18(20)23-17(13)19)7-14(16(15)25-2)12-4-3-5-21-9-12/h3-5,7-10H,6H2,1-2H3,(H4,19,20,22,23)