Vitas-M small molecule compound
(4aS,4bR,7aS,8R)-6-(3-bromophenyl)-8-(2,2-dimethylpropanoyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK558066
SMILES Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)C(C)(C)C)N=CC=C1
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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 C20H20BrN3O3 MW 430.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN3O3/c1-20(2,3)17(25)16-15-14(13-8-5-9-22-24(13)16)18(26)23(19(15)27)12-7-4-6-11(21)10-12/h4-10,13-16H,1-3H3/t13-,14-,15-,16+/m0/s1InChIKey
ZGARRZVIUISVCF-YHUYYLMFSA-NSynonyms
1212481-09-8(3aS4R9aS9bR)2(3bromophenyl)4(22dimethylpropanoyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aS4bR7aS8R)6(3bromophenyl)8(22dimethylpropanoyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aS4bR7aS8R)6(3bromophenyl)8pivaloyl7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1212481098
Brc1cccc(c1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)1N((C@H)2C(=O)C(C)(C)C)N=CC=C1
CC(C)(C)C(=O)C1C2C(C3N1N=CC=C3)C(=O)N(C2=O)C4=CC(=CC=C4)Br
InChI=1SC20H20BrN3O3c120(23)17(25)161514(138592224(13)16)18(26)23(19(15)27)1274611(21)1012h4101316H13H3t13141516+m0s1
MFCD18243061
ZINC000015987307
ZINC15987307
Check stock
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Check stock on Vitas-MAvailable files
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