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

Systemtic Name: 5-[(3-decoxyphenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3-decoxyphenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(3-decoxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3-decoxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3-decoxybenzyl)pyrimidin-4-yl]amine Formula: C21H32N4O MolecularWeight: 356.50498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC(=C1)CC2=CN=C(N=C2N)N

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC(=C1)CC2=CN=C(N=C2N)N

InChI

InChI=1S/C21H32N4O/c1-2-3-4-5-6-7-8-9-13-26-19-12-10-11-17(15-19)14-18-16-24-21(23)25-20(18)22/h10-12,15-16H,2-9,13-14H2,1H3,(H4,22,23,24,25)