Vitas-M small molecule compound
10-[(3-bromo-4-methoxyphenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STL234011
SMILES COc1ccc(cc1Br)C(=O)C1C2C(=O)NC(=O)C2C2N1c1ccccc1C=C2
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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 C22H17BrN2O4 MW 453.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O4/c1-29-16-9-7-12(10-13(16)23)20(26)19-18-17(21(27)24-22(18)28)15-8-6-11-4-2-3-5-14(11)25(15)19/h2-10,15,17-19H,1H3,(H,24,27,28)InChIKey
RDDHTEULAZCMBX-UHFFFAOYSA-NSynonyms
(6aS6bR9aS10R)10(3bromo4methoxybenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
10((3bromo4methoxyphenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)NC3=O)Br
COc1ccc(cc1Br)C(=O)(C@H)1(C@H)2C(=O)NC(=O)(C@H)2(C@H)2N1c1ccccc1C=C2
InChI=1SC22H17BrN2O4c129169712(1013(16)23)20(26)191817(21(27)2422(18)28)158611423514(11)25(15)19h210151719H1H3(H242728)
MFCD24858413
ZINC000033719107
ZINC000248254080
ZINC02334652
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