2-(2-dimethylaminoethylsulfanyl)-6-oxidanyl-5-pentyl-1-phenyl-pyrimidin-4-one

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-6-oxidanyl-5-pentyl-1-phenyl-pyrimidin-4-one Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-6-hydroxy-5-pentyl-1-phenyl-pyrimidin-4-one CAS Name: 2-(2-dimethylaminoethylthio)-6-hydroxy-5-pentyl-1-phenyl-4-pyrimidinone IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-6-hydroxy-5-pentyl-1-phenylpyrimidin-4-one Traditional Name: 5-amyl-2-(2-dimethylaminoethylthio)-6-hydroxy-1-phenyl-pyrimidin-4-one Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N(C(=NC1=O)SCCN(C)C)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCC1=C(N(C(=NC1=O)SCCN(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C19H27N3O2S/c1-4-5-7-12-16-17(23)20-19(25-14-13-21(2)3)22(18(16)24)15-10-8-6-9-11-15/h6,8-11,24H,4-5,7,12-14H2,1-3H3