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

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

Systemtic Name:5-[(3,5-dimethoxy-4-octoxy-phenyl)methyl]pyrimidine-2,4-diamine
Openeye Name:5-[(3,5-dimethoxy-4-octoxy-phenyl)methyl]pyrimidine-2,4-diamine
CAS Name:5-[(3,5-dimethoxy-4-octoxyphenyl)methyl]pyrimidine-2,4-diamine
IUPAC Name:5-[(3,5-dimethoxy-4-octoxyphenyl)methyl]pyrimidine-2,4-diamine
Traditional Name:[2-amino-5-(3,5-dimethoxy-4-octoxy-benzyl)pyrimidin-4-yl]amine
Formula: C21H32N4O3
MolecularWeight: 388.50378
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1OC)CC2=CN=C(N=C2N)N)OC


Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1OC)CC2=CN=C(N=C2N)N)OC


InChI

InChI=1S/C21H32N4O3/c1-4-5-6-7-8-9-10-28-19-17(26-2)12-15(13-18(19)27-3)11-16-14-24-21(23)25-20(16)22/h12-14H,4-11H2,1-3H3,(H4,22,23,24,25)


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