2-(5-oxidanylpentylamino)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one dihydrochloride

Systemtic Name: 2-(5-oxidanylpentylamino)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one dihydrochloride Openeye Name: 2-(5-hydroxypentylamino)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one dihydrochloride CAS Name: 2-(5-hydroxypentylamino)-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one dihydrochloride IUPAC Name: 2-(5-hydroxypentylamino)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one dihydrochloride Traditional Name: 2-(5-hydroxypentylamino)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one dihydrochloride Formula: C15H22Cl2N4O2 MolecularWeight: 361.26678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O2.2ClH/c20-8-3-1-2-7-17-15-18-11-13(14(21)19-15)9-12-5-4-6-16-10-12;;/h4-6,10-11,20H,1-3,7-9H2,(H2,17,18,19,21);2*1H