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

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-5-octyl-6-oxidanyl-1-phenyl-pyrimidin-4-one Openeye Name: 2-(2-diethylaminoethylsulfanyl)-6-hydroxy-5-octyl-1-phenyl-pyrimidin-4-one CAS Name: 2-(2-diethylaminoethylthio)-6-hydroxy-5-octyl-1-phenyl-4-pyrimidinone IUPAC Name: 2-(2-diethylaminoethylsulfanyl)-6-hydroxy-5-octyl-1-phenylpyrimidin-4-one Traditional Name: 2-(2-diethylaminoethylthio)-6-hydroxy-5-octyl-1-phenyl-pyrimidin-4-one Formula: C24H37N3O2S MolecularWeight: 431.63448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N(C(=NC1=O)SCCN(CC)CC)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCC1=C(N(C(=NC1=O)SCCN(CC)CC)C2=CC=CC=C2)O

InChI

InChI=1S/C24H37N3O2S/c1-4-7-8-9-10-14-17-21-22(28)25-24(30-19-18-26(5-2)6-3)27(23(21)29)20-15-12-11-13-16-20/h11-13,15-16,29H,4-10,14,17-19H2,1-3H3