Vitas-M small molecule compound
ethyl 5-(4-bromophenyl)-4,6-dioxo-3-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Catalog ID
STL304728
SMILES CCOC(=O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1
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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 C21H19BrN2O4 MW 443.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O4/c1-2-28-21(27)18-16-15(17(23-18)12-6-4-3-5-7-12)19(25)24(20(16)26)14-10-8-13(22)9-11-14/h3-11,15-18,23H,2H2,1H3InChIKey
VNNZLGIBHWIYBJ-UHFFFAOYSA-NSynonyms
(3aR6aS)ethyl5(4bromophenyl)46dioxo3phenyloctahydropyrrolo(34c)pyrrole1carboxylate
CCOC(=O)C1C2C(C(N1)C3=CC=CC=C3)C(=O)N(C2=O)C4=CC=C(C=C4)Br
CCOC(=O)C1NC((C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1
ETHYL5(4BROMOPHENYL)46DIOXO1PHENYL233A6ATETRAHYDRO1HPYRROLO(34C)PYRROLE3CARBOXYLATE
ethyl5(4bromophenyl)46dioxo3phenyloctahydropyrrolo(34c)pyrrole1carboxylate
InChI=1SC21H19BrN2O4c122821(27)181615(17(2318)126435712)19(25)24(20(16)26)1410813(22)91114h311151823H2H21H3
MFCD00682412
ZINC000002317088
ZINC000226870921
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