2-methyl-5-[2-(4-methylpentylsulfinyl)ethyl]-6-[(E)-2-(2-oxidanylnaphthalen-1-yl)ethenyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-[2-(4-methylpentylsulfinyl)ethyl]-6-[(E)-2-(2-oxidanylnaphthalen-1-yl)ethenyl]-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-5-(2-isohexylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-hydroxy-1-naphthalenyl)ethenyl]-2-methyl-5-[2-(4-methylpentylsulfinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]-2-methyl-5-[2-(4-methylpentylsulfinyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-5-(2-isohexylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=C(C=CC3=CC=CC=C32)O)CCS(=O)CCCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=C(C=CC3=CC=CC=C32)O)CCS(=O)CCCC(C)C

InChI

InChI=1S/C25H30N2O3S/c1-17(2)7-6-15-31(30)16-14-22-23(26-18(3)27-25(22)29)12-11-21-20-9-5-4-8-19(20)10-13-24(21)28/h4-5,8-13,17,28H,6-7,14-16H2,1-3H3,(H,26,27,29)/b12-11+