Vitas-M small molecule compound
[(7E)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](pyridin-4-yl)methanone
Catalog ID
STL286771
SMILES Fc1ccc(cc1)/C=C/1\CCCC2C1=NN(C2c1ccc(cc1)F)C(=O)c1ccncc1
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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 C26H21F2N3O MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21F2N3O/c27-21-8-4-17(5-9-21)16-20-2-1-3-23-24(20)30-31(26(32)19-12-14-29-15-13-19)25(23)18-6-10-22(28)11-7-18/h4-16,23,25H,1-3H2/b20-16+InChIKey
SEHDOBWHDBZZQU-CAPFRKAQSA-NSynonyms
((7E)3(4FLUOROPHENYL)7((4FLUOROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)PYRIDIN4YLMETHANONE
((7E)7(4fluorobenzylidene)3(4fluorophenyl)33a4567hexahydro2Hindazol2yl)(pyridin4yl)methanone
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)F)C1)C(=O)C4=CC=NC=C4)C5=CC=C(C=C5)F
Fc1ccc(cc1)C=C1CCCC2C1=NN(C2c1ccc(cc1)F)C(=O)c1ccncc1
InChI=1SC26H21F2N3Oc27218417(5921)16202132324(20)3031(26(32)19121429151319)25(23)1861022(28)11718h4162325H13H2b2016+
MFCD01627395
ZINC000013301234
ZINC000013301242
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