Vitas-M small molecule compound
(8R,8aS,11aR)-8-[(4-chlorophenyl)carbonyl]-10-(3-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK550677
SMILES Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])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 C26H17ClN4O5 MW 500.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17ClN4O5/c27-16-10-8-14(9-11-16)24(32)23-21-20(22-19-7-2-1-4-15(19)13-28-30(22)23)25(33)29(26(21)34)17-5-3-6-18(12-17)31(35)36/h1-13,20-23H/t20-,21+,22?,23-/m1/s1InChIKey
CRGUNCJDWJDPDE-HNTVYWHESA-NSynonyms
1014082-68-8(8R8aS11aR)8((4chlorophenyl)carbonyl)10(3nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8R8aS11aR)8(4chlorobenzoyl)10(3nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1014082688
C1=CC=C2C3C4C(C(N3N=CC2=C1)C(=O)C5=CC=C(C=C5)Cl)C(=O)N(C4=O)C6=CC(=CC=C6)(N+)(=O)(O)
Clc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O))cccc3
InChI=1SC26H17ClN4O5c271610814(91116)24(32)232120(2219721415(19)132830(22)23)25(33)29(26(21)34)1753618(1217)31(35)36h1132023Ht2021+22?23m1s1
MFCD18242536
ZINC000009348073
ZINC000016039527
Check stock
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Check stock on Vitas-MAvailable files
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