5-[(2,4-dimethoxyphenyl)methyl]-N2-(prop-2-enoxymethyl)pyrimidine-2,4-diamine hydrochloride

Systemtic Name: 5-[(2,4-dimethoxyphenyl)methyl]-N2-(prop-2-enoxymethyl)pyrimidine-2,4-diamine hydrochloride Openeye Name: N2-(allyloxymethyl)-5-[(2,4-dimethoxyphenyl)methyl]pyrimidine-2,4-diamine hydrochloride CAS Name: 5-[(2,4-dimethoxyphenyl)methyl]-N2-(prop-2-enoxymethyl)pyrimidine-2,4-diamine hydrochloride IUPAC Name: 5-[(2,4-dimethoxyphenyl)methyl]-2-N-(prop-2-enoxymethyl)pyrimidine-2,4-diamine hydrochloride Traditional Name: allyloxymethyl-[4-amino-5-(2,4-dimethoxybenzyl)pyrimidin-2-yl]amine hydrochloride Formula: C17H23ClN4O3 MolecularWeight: 366.84252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC2=CN=C(N=C2N)NCOCC=C)OC.Cl

Isomeric SMILES

COC1=CC(=C(C=C1)CC2=CN=C(N=C2N)NCOCC=C)OC.Cl

InChI

InChI=1S/C17H22N4O3.ClH/c1-4-7-24-11-20-17-19-10-13(16(18)21-17)8-12-5-6-14(22-2)9-15(12)23-3;/h4-6,9-10H,1,7-8,11H2,2-3H3,(H3,18,19,20,21);1H