Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-[(4-bromophenyl)carbonyl]-2-chloro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK543195
SMILES Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccc2c(c1)OCO2
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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 C28H18BrClN2O5 MW 577.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18BrClN2O5/c29-16-5-1-15(2-6-16)26(33)25-24-23(19-9-4-14-3-7-17(30)11-20(14)32(19)25)27(34)31(28(24)35)18-8-10-21-22(12-18)37-13-36-21/h1-12,19,23-25H,13H2/t19-,23-,24-,25+/m1/s1InChIKey
YAZXPGNNHQMZDM-KXMWUTRISA-NSynonyms
(6aR6bS9aR10S)8(13benzodioxol5yl)10((4bromophenyl)carbonyl)2chloro9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(benzo(d)(13)dioxol5yl)10(4bromobenzoyl)2chloro9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4C5C=CC6=C(N5C(C4C3=O)C(=O)C7=CC=C(C=C7)Br)C=C(C=C6)Cl
Clc1ccc2c(c1)N1(C@H)(C=C2)(C@@H)2(C@H)((C@H)1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccc2c(c1)OCO2
InChI=1SC28H18BrClN2O5c29165115(2616)26(33)252423(1994143717(30)1120(14)32(19)25)27(34)31(28(24)35)188102122(1218)37133621h112192325H13H2t19232425+m1s1
MFCD18242058
ZINC000001272593
ZINC1272593
Check stock
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Check stock on Vitas-MAvailable files
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