4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-ethyl-6-propyl-phenol hydrochloride

Systemtic Name: 4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-ethyl-6-propyl-phenol hydrochloride Openeye Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-ethyl-6-propyl-phenol hydrochloride CAS Name: 4-[(2,4-diamino-5-pyrimidinyl)methyl]-2-ethyl-6-propylphenol hydrochloride IUPAC Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-ethyl-6-propylphenol hydrochloride Traditional Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-ethyl-6-propyl-phenol hydrochloride Formula: C16H23ClN4O MolecularWeight: 322.83302

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1O)CC)CC2=CN=C(N=C2N)N.Cl

Isomeric SMILES

CCCC1=CC(=CC(=C1O)CC)CC2=CN=C(N=C2N)N.Cl

InChI

InChI=1S/C16H22N4O.ClH/c1-3-5-12-7-10(6-11(4-2)14(12)21)8-13-9-19-16(18)20-15(13)17;/h6-7,9,21H,3-5,8H2,1-2H3,(H4,17,18,19,20);1H