Chem
J-GLOBAL ID：202007020794698944
Nikkaji number：J3.749.564F
4-[2-(4-methoxybenzoylsulfanyl)-1,3-thiazol-4-yl]-5-methyl-2-phenylpyrazol-3-yl 4-methoxybenzoate
4-[2-(4-メトキシベンゾイルスルファニル)-1,3-チアゾール-4-イル]-5-メチル-2-フェニルピラゾール-3-イル4-メトキシベンゾアート
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C29H23N3O5S2
Molecular formula furigana： C29-H23-N3-O5-S2
Molecular weight： 557.640
InChI：
InChI=1S/C29H23N3O5S2/c1-18-25(24-17-38-29(30-24)39-28(34)20-11-15-23(36-3)16-12-20)26(32(31-18)21-7-5-4-6-8-21)37-27(33)19-9-13-22(35-2)14-10-19/h4-17H,1-3H3
InChI key：
VIIAFNDKSCQGAN-UHFFFAOYSA-N
SMILES：
c1(C(=O)Oc2n(nc(c2c2nc(sc2)SC(=O)c2ccc(cc2)OC)C)c2ccccc2)ccc(cc1)OC
Systematic name (3)：
- 4-メトキシ安息香酸1-フェニル-3-メチル-4-[2-(4-メトキシベンゾイルチオ)チアゾール-4-イル]-1H-ピラゾール-5-イル
- 4-[2-(4-メトキシベンゾイルスルファニル)-1,3-チアゾール-4-イル]-3-メチル-1-フェニル-1H-ピラゾール-5-イル4-メトキシベンゾアート
- 4-[2-(4-methoxybenzoylsulfanyl)-1,3-thiazol-4-yl]-3-methyl-1-phenyl-1H-pyrazol-5-yl 4-methoxybenzoate
- 4-[2-(4-メトキシベンゾイルスルファニル)-1,3-チアゾール-4-イル]-5-メチル-2-フェニルピラゾール-3-イル4-メトキシベンゾアート
- 4-[2-(4-methoxybenzoylsulfanyl)-1,3-thiazol-4-yl]-5-methyl-2-phenylpyrazol-3-yl 4-methoxybenzoate
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