Vitas-M small molecule compound
ethyl 5-(4-bromophenyl)-6a-methyl-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK675148
SMILES CCOC(=O)C1=NNC2(C1C(=O)N(C2=O)c1ccc(cc1)Br)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 C15H14BrN3O4 MW 380.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14BrN3O4/c1-3-23-13(21)11-10-12(20)19(9-6-4-8(16)5-7-9)14(22)15(10,2)18-17-11/h4-7,10,18H,3H2,1-2H3InChIKey
VPACSZFGGKRPGL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NNC2(C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C
ethyl5(4bromophenyl)6amethyl46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4BROMOPHENYL)6AMETHYL46DIOXO13ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H14BrN3O4c132313(21)111012(20)19(9648(16)579)14(22)15(102)181711h471018H3H212H3
MFCD01189019
ZINC000001062595
ZINC000004524037
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