2-(2-diethylaminoethylsulfanyl)-6-oxidanyl-5-pentyl-1-(phenylcarbonyl)pyrimidin-4-one

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-6-oxidanyl-5-pentyl-1-(phenylcarbonyl)pyrimidin-4-one Openeye Name: 1-benzoyl-2-(2-diethylaminoethylsulfanyl)-6-hydroxy-5-pentyl-pyrimidin-4-one CAS Name: 1-benzoyl-2-(2-diethylaminoethylthio)-6-hydroxy-5-pentyl-4-pyrimidinone IUPAC Name: 1-benzoyl-2-(2-diethylaminoethylsulfanyl)-6-hydroxy-5-pentylpyrimidin-4-one Traditional Name: 5-amyl-1-benzoyl-2-(2-diethylaminoethylthio)-6-hydroxy-pyrimidin-4-one Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O3S/c1-4-7-9-14-18-19(26)23-22(29-16-15-24(5-2)6-3)25(21(18)28)20(27)17-12-10-8-11-13-17/h8,10-13,28H,4-7,9,14-16H2,1-3H3