Vitas-M small molecule compound
1-{2-[(7Z)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-oxoethyl}-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STL168544
SMILES Fc1ccc(cc1)C1N(N=C2C1CCC/C/2=C/c1ccc(cc1)F)C(=O)CN1N=NC2C1C(=O)N(C2=O)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 C32H26F2N6O3 MW 580.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26F2N6O3/c33-22-13-9-19(10-14-22)17-21-5-4-8-25-27(21)36-40(29(25)20-11-15-23(34)16-12-20)26(41)18-38-30-28(35-37-38)31(42)39(32(30)43)24-6-2-1-3-7-24/h1-3,6-7,9-17,25,28-30H,4-5,8,18H2/b21-17-InChIKey
LQZVXSNWCYLQES-FXBPSFAMSA-NSynonyms
1(2((7Z)7(4fluorobenzylidene)3(4fluorophenyl)33a4567hexahydro2Hindazol2yl)2oxoethyl)5phenyl3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
3(2((7Z)3(4fluorophenyl)7((4fluorophenyl)methylidene)3a456tetrahydro3Hindazol2yl)2oxoethyl)5phenyl3a6adihydropyrrolo(34d)triazole46dione
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)F)C1)C(=O)CN4C5C(C(=O)N(C5=O)C6=CC=CC=C6)N=N4)C7=CC=C(C=C7)F
Fc1ccc(cc1)C1N(N=C2C1CCCC2=Cc1ccc(cc1)F)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccccc1
InChI=1SC32H26F2N6O3c332213919(101422)17215482527(21)3640(29(25)20111523(34)161220)26(41)18383028(353738)31(42)39(32(30)43)246213724h1367917252830H45818H2b2117
MFCD20732282
ZINC000107987507
ZINC000245253721
Check stock
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Check stock on Vitas-MAvailable files
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