Vitas-M small molecule compound
(3aS,6aS)-3-[(4-methoxyphenyl)carbonyl]-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Catalog ID
STK625262
SMILES COc1ccc(cc1)C(=O)C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F
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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 C20H14F3N3O4 MW 417.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F3N3O4/c1-30-13-7-5-10(6-8-13)17(27)15-14-16(25-24-15)19(29)26(18(14)28)12-4-2-3-11(9-12)20(21,22)23/h2-9,14,16,25H,1H3/t14-,16+/m1/s1InChIKey
DFIIYXLKAIGCMS-ZBFHGGJFSA-NSynonyms
308290-19-9(3aS6aS)3((4methoxyphenyl)carbonyl)5(3(trifluoromethyl)phenyl)3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)3(4methoxybenzoyl)5(3(trifluoromethyl)phenyl)16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)3(4methoxybenzoyl)5(3(trifluoromethyl)phenyl)3a6adihydro1Hpyrrolo(34c)pyrazole46dione
308290199
COC1=CC=C(C=C1)C(=O)C2=NNC3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F
COc1ccc(cc1)C(=O)C1=NN(C@H)2(C@@H)1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F
InChI=1SC20H14F3N3O4c130137510(6813)17(27)151416(252415)19(29)26(18(14)28)1242311(912)20(2122)23h29141625H1H3t1416+m1s1
MFCD18246459
ZINC000018190553
ZINC18190553
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