Vitas-M small molecule compound
ethyl (8S,8aR,11aS,11bS)-10-[2-(methoxycarbonyl)phenyl]-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Catalog ID
STK537501
SMILES CCOC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1N=Cc1c2cccc1)c1ccccc1C(=O)OC
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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 C24H21N3O6 MW 447.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O6/c1-3-33-24(31)20-18-17(19-14-9-5-4-8-13(14)12-25-27(19)20)21(28)26(22(18)29)16-11-7-6-10-15(16)23(30)32-2/h4-12,17-20H,3H2,1-2H3/t17-,18+,19+,20-/m0/s1InChIKey
IDWZRTKBFDVXBZ-NMLBUPMWSA-NSynonyms
956151-20-5(8S8aR11aS11bS)ethyl10(2(methoxycarbonyl)phenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
956151205
CCOC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1N=Cc1c2cccc1)c1ccccc1C(=O)OC
CCOC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC=CC=C5C(=O)OC
ethyl(8S8aR11aS11bS)10(2(methoxycarbonyl)phenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
InChI=1SC24H21N3O6c133324(31)201817(1914954813(14)122527(19)20)21(28)26(22(18)29)1611761015(16)23(30)322h4121720H3H212H3t1718+19+20m0s1
MFCD18241690
ZINC000016034906
ZINC16034906
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