Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-8-[(4-bromophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK545757
SMILES O=C1NC(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1ccc(cc1)Br)N1[C@@H]2c2ccccc2C=C1
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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 C21H15BrN2O3 MW 423.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O3/c22-13-7-5-12(6-8-13)19(25)18-16-15(20(26)23-21(16)27)17-14-4-2-1-3-11(14)9-10-24(17)18/h1-10,15-18H,(H,23,26,27)/t15-,16+,17+,18-/m0/s1InChIKey
PKMLOWTZPCFGRH-MLHJIOFPSA-NSynonyms
1212429-73-6(8S8aR11aS11bS)8((4bromophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8(4bromobenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1212429736
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)C5=CC=C(C=C5)Br)C(=O)NC4=O
InChI=1SC21H15BrN2O3c22137512(6813)19(25)181615(20(26)2321(16)27)1714421311(14)91024(17)18h1101518H(H232627)t1516+17+18m0s1
MFCD18242237
O=C1NC(=O)(C@H)2(C@@H)1(C@@H)(C(=O)c1ccc(cc1)Br)N1(C@@H)2c2ccccc2C=C1
ZINC000016038199
ZINC16038199
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