5-[(3-octoxyphenyl)methyl]-4,5-dihydropyrimidine-2,6-diamine

Systemtic Name: 5-[(3-octoxyphenyl)methyl]-4,5-dihydropyrimidine-2,6-diamine Openeye Name: 5-[(3-octoxyphenyl)methyl]-4,5-dihydropyrimidine-2,6-diamine CAS Name: 5-[(3-octoxyphenyl)methyl]-4,5-dihydropyrimidine-2,6-diamine IUPAC Name: 5-[(3-octoxyphenyl)methyl]-4,5-dihydropyrimidine-2,6-diamine Traditional Name: [2-amino-5-(3-octoxybenzyl)-4,5-dihydropyrimidin-6-yl]amine Formula: C19H30N4O MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC(=C1)CC2CN=C(N=C2N)N

Isomeric SMILES

CCCCCCCCOC1=CC=CC(=C1)CC2CN=C(N=C2N)N

InChI

InChI=1S/C19H30N4O/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/h8-10,13,16H,2-7,11-12,14H2,1H3,(H4,20,21,22,23)