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

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-6-oxidanyl-1-phenyl-pyrimidin-4-one Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-6-hydroxy-1-phenyl-pyrimidin-4-one CAS Name: 2-(2-dimethylaminoethylthio)-5-hexyl-6-hydroxy-1-phenyl-4-pyrimidinone IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-5-hexyl-6-hydroxy-1-phenylpyrimidin-4-one Traditional Name: 2-(2-dimethylaminoethylthio)-5-hexyl-6-hydroxy-1-phenyl-pyrimidin-4-one Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N(C(=NC1=O)SCCN(C)C)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCC1=C(N(C(=NC1=O)SCCN(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C20H29N3O2S/c1-4-5-6-10-13-17-18(24)21-20(26-15-14-22(2)3)23(19(17)25)16-11-8-7-9-12-16/h7-9,11-12,25H,4-6,10,13-15H2,1-3H3