5-[(3-ethyl-4-methoxy-5-propyl-phenyl)methyl]pyrimidine-2,4-diamine hydrochloride

Systemtic Name: 5-[(3-ethyl-4-methoxy-5-propyl-phenyl)methyl]pyrimidine-2,4-diamine hydrochloride Openeye Name: 5-[(3-ethyl-4-methoxy-5-propyl-phenyl)methyl]pyrimidine-2,4-diamine hydrochloride CAS Name: 5-[(3-ethyl-4-methoxy-5-propylphenyl)methyl]pyrimidine-2,4-diamine hydrochloride IUPAC Name: 5-[(3-ethyl-4-methoxy-5-propylphenyl)methyl]pyrimidine-2,4-diamine hydrochloride Traditional Name: [2-amino-5-(3-ethyl-4-methoxy-5-propyl-benzyl)pyrimidin-4-yl]amine hydrochloride Formula: C17H25ClN4O MolecularWeight: 336.8596

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1OC)CC)CC2=CN=C(N=C2N)N.Cl

Isomeric SMILES

CCCC1=CC(=CC(=C1OC)CC)CC2=CN=C(N=C2N)N.Cl

InChI

InChI=1S/C17H24N4O.ClH/c1-4-6-13-8-11(7-12(5-2)15(13)22-3)9-14-10-20-17(19)21-16(14)18;/h7-8,10H,4-6,9H2,1-3H3,(H4,18,19,20,21);1H