2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-(2-isopentylsulfinylethyl)-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(2-isoamylsulfinylethyl)-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=NC=C2)CCS(=O)CCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=NC=C2)CCS(=O)CCC(C)C

InChI

InChI=1S/C19H25N3O2S/c1-14(2)8-12-25(24)13-9-17-18(21-15(3)22-19(17)23)5-4-16-6-10-20-11-7-16/h4-7,10-11,14H,8-9,12-13H2,1-3H3,(H,21,22,23)/b5-4+