Chem
J-GLOBAL ID:200907076918386528
Nikkaji number:J575.297C
SR-49059
SR-49059
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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:
C28 H27 Cl2 N3 O7 S
Molecular formula furigana:
C28-H27-CL2-N3-O7-S
Molecular weight:
620.500
InChI:
InChI=1S/C28H27Cl2N3O7S/c1-39-23-12-10-17(15-24(23)40-2)41(37,38)33-21-11-9-16(29)14-19(21)28(36,18-6-3-4-7-20(18)30)25(33)27(35)32-13-5-8-22(32)26(31)34/h3-4,6-7,9-12,14-15,22,25,36H,5,8,13H2,1-2H3,(H2,31,34)/t22-,25-,28+/m0/s1
InChI key:
CEBYCSRFKCEUSW-NAYZPBBASA-N
SMILES:
COc1ccc(cc1OC)S(=O)(=O)N1[C@@H](C(=O)N2CCC[C@H]2C(=O)N)[C@](O)(c2cc(Cl)ccc12)c1ccccc1Cl
Systematic name (3):
(2S)-1-[[[(2R)-3α-ヒドロキシ-3-(2-クロロフェニル)-1-[(3,4-ジメトキシフェニル)スルホニル]-2,3-ジヒドロ-5-クロロ-1H-インドール]-2β-イル]カルボニル]-2-ピロリジンカルボアミド
(2S)-1-[(2R,3S)-5-クロロ-3-(2-クロロフェニル)-1-(3,4-ジメトキシベンゼンスルホニル)-3-ヒドロキシ-2,3-ジヒドロ-1H-インドール-2-カルボニル]ピロリジン-2-カルボキサミド
(2S)-1-[(2R,3S)-5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxybenzenesulfonyl)-3-hydroxy-2,3-dihydro-1H-indole-2-carbonyl]pyrrolidine-2-carboxamide
Other name (2):
SR-49059
(2S)-1-[[[(2R)-3α-Hydroxy-3-(2-chlorophenyl)-1-[(3,4-dimethoxyphenyl)sulfonyl]-2,3-dihydro-5-chloro-1H-indol]-2β-yl]carbonyl]-2-pyrrolidinecarboxamide
CAS registry number:
150375-75-0
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