Vitas-M small molecule compound
tert-butyl (8R,8aS,11aR)-10-(4-bromophenyl)-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
STK552214
SMILES Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C
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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 C24H22BrN3O4 MW 496.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O4/c1-24(2,3)32-23(31)20-18-17(19-16-7-5-4-6-13(16)12-26-28(19)20)21(29)27(22(18)30)15-10-8-14(25)9-11-15/h4-12,17-20H,1-3H3/t17-,18+,19?,20-/m1/s1InChIKey
WSXKDFNUTDBICR-JIRNRHONSA-NSynonyms
1014082-80-4(8R8aS11aR)tertbutyl10(4bromophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
1014082804
Brc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C
CC(C)(C)OC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC=C(C=C5)Br
InChI=1SC24H22BrN3O4c124(23)3223(31)201817(1916754613(16)122628(19)20)21(29)27(22(18)30)1510814(25)91115h4121720H13H3t1718+19?20m1s1
MFCD18242632
tertbutyl(8R8aS11aR)10(4bromophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
ZINC000009432081
ZINC000018142470
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