2-[3-(1H-imidazol-5-yl)propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one trihydrochloride

Systemtic Name: 2-[3-(1H-imidazol-5-yl)propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one trihydrochloride Openeye Name: 2-[3-(1H-imidazol-5-yl)propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one trihydrochloride CAS Name: 2-[3-(1H-imidazol-5-yl)propylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one trihydrochloride IUPAC Name: 2-[3-(1H-imidazol-5-yl)propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one trihydrochloride Traditional Name: 2-[3-(1H-imidazol-5-yl)propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one trihydrochloride Formula: C16H21Cl3N6O MolecularWeight: 419.73654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCC3=CN=CN3.Cl.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCC3=CN=CN3.Cl.Cl.Cl

InChI

InChI=1S/C16H18N6O.3ClH/c23-15-13(7-12-3-1-5-17-8-12)9-20-16(22-15)19-6-2-4-14-10-18-11-21-14;;;/h1,3,5,8-11H,2,4,6-7H2,(H,18,21)(H2,19,20,22,23);3*1H