Vitas-M small molecule compound
cyclopentyl 4-(5-bromothiophen-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK062187
SMILES Brc1ccc(s1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H26BrNO3S MW 464.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO3S/c1-12-18(21(26)27-13-6-4-5-7-13)20(16-8-9-17(23)28-16)19-14(24-12)10-22(2,3)11-15(19)25/h8-9,13,20,24H,4-7,10-11H2,1-3H3InChIKey
GRDZHISNMNBVID-UHFFFAOYSA-NSynonyms
297157-78-9297157789
Brc1ccc(s1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(S3)Br)C(=O)OC4CCCC4
cyclopentyl4(5bromothiophen2yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(5bromothiophen2yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC22H26BrNO3Sc11218(21(26)2713645713)20(168917(23)2816)1914(2412)1022(23)1115(19)25h89132024H471011H213H3
MFCD01975571
STK062187
ZINC000000674700
ZINC000000674705
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