Vitas-M small molecule compound
8-[(4-fluorophenyl)carbonyl]-10-(2-methyl-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STL240777
SMILES Fc1ccc(cc1)C(=O)C1N2N=Cc3c(C2C2C1C(=O)N(C2=O)c1cc(ccc1C)[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 C27H19FN4O5 MW 498.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN4O5/c1-14-6-11-18(32(36)37)12-20(14)30-26(34)21-22(27(30)35)24(25(33)15-7-9-17(28)10-8-15)31-23(21)19-5-3-2-4-16(19)13-29-31/h2-13,21-24H,1H3InChIKey
FIJHVXBCEJWKML-UHFFFAOYSA-NSynonyms
(8R8aS11aR)8(4fluorobenzoyl)10(2methyl5nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
8((4fluorophenyl)carbonyl)10(2methyl5nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)C6=CC=C(C=C6)F
Fc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1cc(ccc1C)(N+)(=O)(O))cccc3
Fc1ccc(cc1)C(=O)C1N2N=Cc3c(C2C2C1C(=O)N(C2=O)c1cc(ccc1C)(N+)(=O)(O))cccc3
InChI=1SC27H19FN4O5c11461118(32(36)37)1220(14)3026(34)2122(27(30)35)24(25(33)157917(28)10815)3123(21)19532416(19)132931h2132124H1H3
MFCD04078890
ZINC000009353068
ZINC000248085812
Check stock
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Check stock on Vitas-MAvailable files
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