Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-8-acetyl-10-(3-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK554211
SMILES Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)C)N=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 C21H16FN3O3 MW 377.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O3/c1-11(26)18-16-17(19-15-8-3-2-5-12(15)10-23-25(18)19)21(28)24(20(16)27)14-7-4-6-13(22)9-14/h2-10,16-19H,1H3/t16-,17+,18-,19-/m1/s1InChIKey
LMMONTTWJUAPIG-FCGDIQPGSA-NSynonyms
1212476-38-4(8S8aR11aS11bS)8acetyl10(3fluorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1212476384
CC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC(=CC=C5)F
Fc1cccc(c1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)C)N=Cc2c1cccc2
InChI=1SC21H16FN3O3c111(26)181617(1915832512(15)102325(18)19)21(28)24(20(16)27)1474613(22)914h2101619H1H3t1617+1819m1s1
MFCD18242782
ZINC000008739655
ZINC08739655
ZINC8739655
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