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

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-6-oxidanyl-1-phenyl-5-(phenylmethyl)pyrimidin-4-one hydrochloride Openeye Name: 5-benzyl-2-(2-diethylaminoethylsulfanyl)-6-hydroxy-1-phenyl-pyrimidin-4-one hydrochloride CAS Name: 2-(2-diethylaminoethylthio)-6-hydroxy-1-phenyl-5-(phenylmethyl)-4-pyrimidinone hydrochloride IUPAC Name: 5-benzyl-2-(2-diethylaminoethylsulfanyl)-6-hydroxy-1-phenylpyrimidin-4-one hydrochloride Traditional Name: 5-benzyl-2-(2-diethylaminoethylthio)-6-hydroxy-1-phenyl-pyrimidin-4-one hydrochloride Formula: C23H28ClN3O2S MolecularWeight: 446.00532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C23H27N3O2S.ClH/c1-3-25(4-2)15-16-29-23-24-21(27)20(17-18-11-7-5-8-12-18)22(28)26(23)19-13-9-6-10-14-19;/h5-14,28H,3-4,15-17H2,1-2H3;1H