Vitas-M small molecule compound
(8R,8aS,11aR,11bR)-8-[(3-bromo-4-methoxyphenyl)carbonyl]-10-(2,4-dimethylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK547112
SMILES COc1ccc(cc1Br)C(=O)[C@@H]1N2C=Cc3c([C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3
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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 C30H25BrN2O4 MW 557.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25BrN2O4/c1-16-8-10-22(17(2)14-16)33-29(35)24-25(30(33)36)27(28(34)19-9-11-23(37-3)21(31)15-19)32-13-12-18-6-4-5-7-20(18)26(24)32/h4-15,24-27H,1-3H3/t24-,25+,26+,27-/m1/s1InChIKey
XDFYQWNFWAUURD-LGTXBLIGSA-NSynonyms
(8R8aS11aR11bR)8((3bromo4methoxyphenyl)carbonyl)10(24dimethylphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8R8aS11aR11bR)8(3bromo4methoxybenzoyl)10(24dimethylphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC(=C(C=C6)OC)Br)C
COc1ccc(cc1Br)C(=O)(C@@H)1N2C=Cc3c((C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3
InChI=1SC30H25BrN2O4c11681022(17(2)1416)3329(35)2425(30(33)36)27(28(34)1991123(373)21(31)1519)32131218645720(18)26(24)32h4152427H13H3t2425+26+27m1s1
MFCD18242330
ZINC000102447054
ZINC102447054
Check stock
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Check stock on Vitas-MAvailable files
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