Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-8-acetyl-10-(2,4-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK554236
SMILES CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1N=Cc1c2cccc1)c1ccc(cc1Cl)Cl
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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 C21H15Cl2N3O3 MW 428.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N3O3/c1-10(27)18-16-17(19-13-5-3-2-4-11(13)9-24-26(18)19)21(29)25(20(16)28)15-7-6-12(22)8-14(15)23/h2-9,16-19H,1H3/t16-,17+,18-,19-/m1/s1InChIKey
AGIHTFSYDMJLAP-FCGDIQPGSA-NSynonyms
1014083-59-0(8S8aR11aS11bS)8acetyl10(24dichlorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1014083590
CC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1N=Cc1c2cccc1)c1ccc(cc1Cl)Cl
CC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=C(C=C(C=C5)Cl)Cl
InChI=1SC21H15Cl2N3O3c110(27)181617(1913532411(13)92426(18)19)21(29)25(20(16)28)157612(22)814(15)23h291619H1H3t1617+1819m1s1
MFCD18242785
ZINC000016039180
ZINC16039180
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