Vitas-M small molecule compound
1-[(3aS,4R,9bR)-4-(5-bromo-2-methoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]ethanone
Catalog ID
STL221964
SMILES COc1ccc(cc1[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)C(=O)C)Br
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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 C21H20BrNO2 MW 398.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrNO2/c1-12(24)13-6-8-19-17(10-13)15-4-3-5-16(15)21(23-19)18-11-14(22)7-9-20(18)25-2/h3-4,6-11,15-16,21,23H,5H2,1-2H3/t15-,16+,21-/m1/s1InChIKey
FGWJVUVUPVNYQO-VWKPWSFCSA-NSynonyms
1((3aS4R9bR)4(5bromo2methoxyphenyl)3a459btetrahydro3Hcyclopenta(c)quinolin8yl)ethanone
CC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=C(C=CC(=C4)Br)OC
COc1ccc(cc1(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)C(=O)C)Br
InChI=1SC21H20BrNO2c112(24)13681917(1013)1543516(15)21(2319)181114(22)7920(18)252h3461115162123H5H212H3t1516+21m1s1
MFCD24857517
ZINC000001053920
ZINC01053920
ZINC1053920
Check stock
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