2-(2-diethylaminoethylsulfanyl)-5-ethyl-6-oxidanyl-1-phenyl-pyrimidin-4-one hydrochloride

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-5-ethyl-6-oxidanyl-1-phenyl-pyrimidin-4-one hydrochloride Openeye Name: 2-(2-diethylaminoethylsulfanyl)-5-ethyl-6-hydroxy-1-phenyl-pyrimidin-4-one hydrochloride CAS Name: 2-(2-diethylaminoethylthio)-5-ethyl-6-hydroxy-1-phenyl-4-pyrimidinone hydrochloride IUPAC Name: 2-(2-diethylaminoethylsulfanyl)-5-ethyl-6-hydroxy-1-phenylpyrimidin-4-one hydrochloride Traditional Name: 2-(2-diethylaminoethylthio)-5-ethyl-6-hydroxy-1-phenyl-pyrimidin-4-one hydrochloride Formula: C18H26ClN3O2S MolecularWeight: 383.93594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCCN(CC)CC)C2=CC=CC=C2)O.Cl

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCCN(CC)CC)C2=CC=CC=C2)O.Cl

InChI

InChI=1S/C18H25N3O2S.ClH/c1-4-15-16(22)19-18(24-13-12-20(5-2)6-3)21(17(15)23)14-10-8-7-9-11-14;/h7-11,23H,4-6,12-13H2,1-3H3;1H