5-[(4-dodecoxy-3,5-diethyl-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(4-dodecoxy-3,5-diethyl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4-dodecoxy-3,5-diethyl-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4-dodecoxy-3,5-diethylphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4-dodecoxy-3,5-diethylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3,5-diethyl-4-lauryloxy-benzyl)pyrimidin-4-yl]amine Formula: C27H44N4O MolecularWeight: 440.66446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1CC)CC2=CN=C(N=C2N)N)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1CC)CC2=CN=C(N=C2N)N)CC

InChI

InChI=1S/C27H44N4O/c1-4-7-8-9-10-11-12-13-14-15-16-32-25-22(5-2)17-21(18-23(25)6-3)19-24-20-30-27(29)31-26(24)28/h17-18,20H,4-16,19H2,1-3H3,(H4,28,29,30,31)