1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLIC ACID, 5-CYANO-3-[4-[(METHYLSULFONYL)OXY]BUTYL]-, 1,1-DIMETHYLETHYL ESTER

CAS号
1187322-57-1
CCD编号
CCD02500508
分子式
C18 H23 N3 O5 S
分子量
393.462

基本信息

产品名称: 1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLIC ACID, 5-CYANO-3-[4-[(METHYLSULFONYL)OXY]BUTYL]-, 1,1-DIMETHYLETHYL ESTER
CAS: 1187322-57-1
英文同义词: 1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLIC ACID, 5-CYANO-3-[4-[(METHYLSULFONYL)OXY]BUTYL]-, 1,1-DIMETHYLETHYL ESTER
MDL号: MFCD16039013
氢键受体数量: 8
氢键供体数量: 0
Smile: CC(C)(C)OC(=O)n1cc(c2c1ncc(c2)C#N)CCCCOS(=O)(=O)C
InChi: InChI=1S/C18H23N3O5S/c1-18(2,3)26-17(22)21-12-14(7-5-6-8-25-27(4,23)24)15-9-13(10-19)11-20-16(15)21/h9,11-12H,5-8H2,1-4H3
InChiKey: InChIKey=AEOIHQSLZJFJKD-UHFFFAOYSA-N

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