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

Systemtic Name: 5-[(4-heptoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-heptoxy-3-methoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-heptoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-heptoxy-3-methoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-heptoxy-3-methoxy-benzyl)pyrimidin-4-yl]amine Formula: C19H28N4O2 MolecularWeight: 344.45122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC

InChI

InChI=1S/C19H28N4O2/c1-3-4-5-6-7-10-25-16-9-8-14(12-17(16)24-2)11-15-13-22-19(21)23-18(15)20/h8-9,12-13H,3-7,10-11H2,1-2H3,(H4,20,21,22,23)