N4-[3-(3-azanylpropoxy)propyl]-5-hexyl-6-methyl-N2-octyl-pyrimidine-2,4-diamine

Systemtic Name: N4-[3-(3-azanylpropoxy)propyl]-5-hexyl-6-methyl-N2-octyl-pyrimidine-2,4-diamine Openeye Name: N4-[3-(3-aminopropoxy)propyl]-5-hexyl-6-methyl-N2-octyl-pyrimidine-2,4-diamine CAS Name: N4-[3-(3-aminopropoxy)propyl]-5-hexyl-6-methyl-N2-octylpyrimidine-2,4-diamine IUPAC Name: 4-N-[3-(3-aminopropoxy)propyl]-5-hexyl-6-methyl-2-N-octylpyrimidine-2,4-diamine Traditional Name: 3-(3-aminopropoxy)propyl-[5-hexyl-6-methyl-2-(octylamino)pyrimidin-4-yl]amine Formula: C25H49N5O MolecularWeight: 435.68946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=C(C(=N1)NCCCOCCCN)CCCCCC)C

Isomeric SMILES

CCCCCCCCNC1=NC(=C(C(=N1)NCCCOCCCN)CCCCCC)C

InChI

InChI=1S/C25H49N5O/c1-4-6-8-10-11-13-18-28-25-29-22(3)23(16-12-9-7-5-2)24(30-25)27-19-15-21-31-20-14-17-26/h4-21,26H2,1-3H3,(H2,27,28,29,30)