6-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(4-dimethylaminophenyl)vinyl]-2-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(4-dimethylaminophenyl)ethenyl]-2-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one Traditional Name: 5-(2-amylsulfinylethyl)-6-[(E)-2-(4-dimethylaminophenyl)vinyl]-2-methyl-1H-pyrimidin-4-one Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)CCC1=C(NC(=NC1=O)C)C=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCCS(=O)CCC1=C(NC(=NC1=O)C)/C=C/C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C22H31N3O2S/c1-5-6-7-15-28(27)16-14-20-21(23-17(2)24-22(20)26)13-10-18-8-11-19(12-9-18)25(3)4/h8-13H,5-7,14-16H2,1-4H3,(H,23,24,26)/b13-10+