5-[(3-octoxyphenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(3-octoxyphenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3-octoxyphenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(3-octoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3-octoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3-octoxybenzyl)pyrimidin-4-yl]amine Formula: C19H28N4O MolecularWeight: 328.45182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O/c1-2-3-4-5-6-7-11-24-17-10-8-9-15(13-17)12-16-14-22-19(21)23-18(16)20/h8-10,13-14H,2-7,11-12H2,1H3,(H4,20,21,22,23)