Vitas-M small molecule compound
(8S,8aR,11aS)-8-(1,3-benzodioxol-5-ylcarbonyl)-10-(2,4-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL008925
SMILES Clc1ccc(c(c1)Cl)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc3c(c2)OCO3)C=Cc2c1cccc2
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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 C28H18Cl2N2O5 MW 533.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18Cl2N2O5/c29-16-6-7-19(18(30)12-16)32-27(34)22-23(28(32)35)25(26(33)15-5-8-20-21(11-15)37-13-36-20)31-10-9-14-3-1-2-4-17(14)24(22)31/h1-12,22-25H,13H2/t22-,23+,24?,25-/m0/s1InChIKey
XSTNNFOIHAYVAP-NPZNXQLHSA-NSynonyms
1013855-55-4(8S8aR11aS)8(13benzodioxol5ylcarbonyl)10(24dichlorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(benzo(d)(13)dioxole5carbonyl)10(24dichlorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1013855554
C1OC2=C(O1)C=C(C=C2)C(=O)C3C4C(C5N3C=CC6=CC=CC=C56)C(=O)N(C4=O)C7=C(C=C(C=C7)Cl)Cl
Clc1ccc(c(c1)Cl)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2ccc3c(c2)OCO3)C=Cc2c1cccc2
InChI=1SC28H18Cl2N2O5c29166719(18(30)1216)3227(34)2223(28(32)35)25(26(33)15582021(1115)37133620)3110914312417(14)24(22)31h1122225H13H2t2223+24?25m0s1
ZINC000101150506
ZINC000101150507
Check stock
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Check stock on Vitas-MAvailable files
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