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

Systemtic Name: 2-methyl-6-[(E)-2-(2-oxidanylnaphthalen-1-yl)ethenyl]-5-(2-phenethylsulfinylethyl)-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-2-methyl-5-(2-phenethylsulfinylethyl)-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-hydroxy-1-naphthalenyl)ethenyl]-2-methyl-5-(2-phenethylsulfinylethyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]-2-methyl-5-(2-phenethylsulfinylethyl)-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-hydroxy-1-naphthyl)vinyl]-2-methyl-5-(2-phenethylsulfinylethyl)-1H-pyrimidin-4-one Formula: C27H26N2O3S MolecularWeight: 458.57194

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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)CCC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=C(C=CC3=CC=CC=C32)O)CCS(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O3S/c1-19-28-25(13-12-23-22-10-6-5-9-21(22)11-14-26(23)30)24(27(31)29-19)16-18-33(32)17-15-20-7-3-2-4-8-20/h2-14,30H,15-18H2,1H3,(H,28,29,31)/b13-12+