Primary record
Benzoic acid, 4-((((1S)-2-((2E)-3-(3-chloro-2-fluoro-6-(1H-tetrazol-1-yl)phenyl)-1-oxo-2-propen-1-yl)-1,2,3,4-tetrahydro-5-(4-methyl-2-oxo-1-piperazinyl)-1-isoquinolinyl)carbonyl)amino)-
- 库存
- 9,917 克
- 纯度
- 99.7 %
- CAS
- 1430114-34-3
化合物标识与属性
- CAS
- 1430114-34-3
- PubChem CID
- 71548883
- SMILES
- CN1CCN(C(=O)C1)C2=CC=CC3=C2CCN([C@@H]3C(=O)NC4=CC=C(C=C4)C(=O)O)C(=O)/C=C/C5=C(C=CC(=C5F)Cl)N6C=NN=N6
- Canonical SMILES
- CN1CCN(c2cccc3c2CCN(C(=O)/C=C/c2c(-n4cnnn4)ccc(Cl)c2F)[C@@H]3C(=O)Nc2ccc(C(=O)O)cc2)C(=O)C1
名称与同义词
- BMS-962212
- UNII-VWJ4VVZ3OU
- VWJ4VVZ3OU
- 1430114-34-3
- RefChem:120761
- GTPL9884
- orb1707528
- CHEMBL4073292
- SCHEMBL14873796
- BDBM349975
- EX-A3253
- BMS962212
- BMS 962212 [WHO-DD]
- US10208021, Example 184
- AKOS040741391
- BMS-962212?
- compound 55 [PMID: 29077405]
- DA-71593
- MS-31006
- HY-117290
- CS-0065189
- J3.739.186G
- 4-[[(1S)-2-[(E)-3-[3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl]prop-2-enoyl]-5-(4-methyl-2-oxopiperazin-1-yl)-3,4-dihydro-1H-isoquinoline-1-carbonyl]amino]benzoic acid
- A942515
- (S,E)-4-(2-(3-(3-chloro-2-fluoro-6-(1h-tetrazol-1-yl)phenyl)acryloyl)-5-(4-methyl-2-oxopiperazin-1-yl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid
- Benzoic acid, 4-((((1S)-2-((2E)-3-(3-chloro-2-fluoro-6-(1H-tetrazol-1-yl)phenyl)-1-oxo-2-propen-1-yl)-1,2,3,4-tetrahydro-5-(4-methyl-2-oxo-1-piperazinyl)-1-isoquinolinyl)carbonyl)amino)-
- 4-[(1S)-2-[(2E)-3-[3-chloro-2-fluoro-6-(1H-1,2,3,4-tetrazol-1-yl)phenyl]prop-2-enoyl]-5-(4-methyl-2-oxopiperazin-1-yl)-1,2,3,4-tetrahydroisoquinoline-1-amido]benzoic acid
- (S,E)-4-(2-(3-(3-Chloro-2-fluoro-6-(1H-tetrazol-1- yl)phenyl)acryloyl)-5-(4-methyl-2-oxopiperazin-1-yl)- 1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid
- (S,E)-4-(2-(3-(3-chloro-2-fluoro-6-(1H-tetrazol-1-yl)phenyl)acryloyl)-5-(4-methyl-2-oxopiperazin-1-yl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid, TFA salt
- (S,E)-4-(2-(3-(3-chloro-2-fluoro-6-(1h-tetrazol-1-yl)phenyl)acryloyl)-5-(4-methyl-2-oxopiperazin-1-yl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoicacid
- 4-(((1S)-2-((E)-3-(3-chloro-2-fluoro-6-(tetrazol-1-yl)phenyl)prop-2-enoyl)-5-(4-methyl-2-oxopiperazin-1-yl)-3,4-dihydro-1H-isoquinoline-1-carbonyl)amino)benzoic acid