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

Systemtic Name: 2-(5-chloranylpentylamino)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one dihydrochloride Openeye Name: 2-(5-chloropentylamino)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one dihydrochloride CAS Name: 2-(5-chloropentylamino)-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one dihydrochloride IUPAC Name: 2-(5-chloropentylamino)-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one dihydrochloride Traditional Name: 2-(5-chloropentylamino)-5-(3-pyridylmethyl)-1H-pyrimidin-6-one dihydrochloride Formula: C15H21Cl3N4O MolecularWeight: 379.71244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN4O.2ClH/c16-6-2-1-3-8-18-15-19-11-13(14(21)20-15)9-12-5-4-7-17-10-12;;/h4-5,7,10-11H,1-3,6,8-9H2,(H2,18,19,20,21);2*1H