1-azanyl-5-[(phenylmethyl)amino]-2-propyl-pyrimidin-4-one hydrate dihydrochloride

Systemtic Name: 1-azanyl-5-[(phenylmethyl)amino]-2-propyl-pyrimidin-4-one hydrate dihydrochloride Openeye Name: 1-amino-5-(benzylamino)-2-propyl-pyrimidin-4-one hydrate dihydrochloride CAS Name: 1-amino-5-[(phenylmethyl)amino]-2-propyl-4-pyrimidinone hydrate dihydrochloride IUPAC Name: 1-amino-5-(benzylamino)-2-propylpyrimidin-4-one hydrate dihydrochloride Traditional Name: 1-amino-5-(benzylamino)-2-propyl-pyrimidin-4-one hydrate dihydrochloride Formula: C14H22Cl2N4O2 MolecularWeight: 349.25608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=O)C(=CN1N)NCC2=CC=CC=C2.O.Cl.Cl

Isomeric SMILES

CCCC1=NC(=O)C(=CN1N)NCC2=CC=CC=C2.O.Cl.Cl

InChI

InChI=1S/C14H18N4O.2ClH.H2O/c1-2-6-13-17-14(19)12(10-18(13)15)16-9-11-7-4-3-5-8-11;;;/h3-5,7-8,10,16H,2,6,9,15H2,1H3;2*1H;1H2