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

Systemtic Name: 5-[(4-methoxy-3-octoxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-methoxy-3-octoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-methoxy-3-octoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-methoxy-3-octoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-methoxy-3-octoxy-benzyl)pyrimidin-4-yl]amine Formula: C20H30N4O2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=CC(=C1)CC2=CN=C(N=C2N)N)OC

InChI

InChI=1S/C20H30N4O2/c1-3-4-5-6-7-8-11-26-18-13-15(9-10-17(18)25-2)12-16-14-23-20(22)24-19(16)21/h9-10,13-14H,3-8,11-12H2,1-2H3,(H4,21,22,23,24)