Chem
J-GLOBAL ID:200907075551568946
Nikkaji number:J723.627A
Ro-46-8443
N-[2-(4-メトキシフェニル)-5-(2-メトキシフェノキシ)-6-[(R)-2,3-ジヒドロキシプロポキシ]ピリミジン-4-イル]-4-(tert-ブチル)ベンゼンスルホンアミド
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Substance type:
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
Molecular formula:
C31 H35 N3 O8 S
Molecular formula furigana:
C31-H35-N3-O8-S
Molecular weight:
609.690
InChI:
InChI=1S/C31H35N3O8S/c1-31(2,3)21-12-16-24(17-13-21)43(37,38)34-29-27(42-26-9-7-6-8-25(26)40-5)30(41-19-22(36)18-35)33-28(32-29)20-10-14-23(39-4)15-11-20/h6-17,22,35-36H,18-19H2,1-5H3,(H,32,33,34)/t22-/m1/s1
InChI key:
DRIHNVYRUGBDHI-JOCHJYFZSA-N
SMILES:
COc1ccc(cc1)c1nc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c(Oc2ccccc2OC)c(OC[C@H](O)CO)n1
Systematic name (3):
N-[2-(4-メトキシフェニル)-5-(2-メトキシフェノキシ)-6-[(R)-2,3-ジヒドロキシプロポキシ]ピリミジン-4-イル]-4-(tert-ブチル)ベンゼンスルホンアミド
4-tert-ブチル-N-{6-[(2R)-2,3-ジヒドロキシプロポキシ]-5-(2-メトキシフェノキシ)-2-(4-メトキシフェニル)ピリミジン-4-イル}ベンゼン-1-スルホンアミド
4-tert-butyl-N-{6-[(2R)-2,3-dihydroxypropoxy]-5-(2-methoxyphenoxy)-2-(4-methoxyphenyl)pyrimidin-4-yl}benzene-1-sulfonamide
Other name (2):
Ro-46-8443
N-[2-(4-Methoxyphenyl)-5-(2-methoxyphenoxy)-6-[(R)-2,3-dihydroxypropoxy]pyrimidin-4-yl]-4-(tert-butyl)benzenesulfonamide
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