Vitas-M small molecule compound
(7E)-N-(4-chlorophenyl)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carboxamide
Catalog ID
STL509177
SMILES Fc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)F)C(=O)Nc1ccc(cc1)Cl
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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 C27H22ClF2N3O MW 477.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClF2N3O/c28-20-8-14-23(15-9-20)31-27(34)33-26(18-6-12-22(30)13-7-18)24-3-1-2-19(25(24)32-33)16-17-4-10-21(29)11-5-17/h4-16,24,26H,1-3H2,(H,31,34)/b19-16+InChIKey
BHXNYXMSKAALSY-KNTRCKAVSA-NSynonyms
(7~(E))~(N)(4chlorophenyl)3(4fluorophenyl)7((4fluorophenyl)methylidene)3~(a)456tetrahydro3~(H)indazole2carboxamide
(7E)N(4CHLOROPHENYL)3(4FLUOROPHENYL)7((4FLUOROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOLE2CARBOXAMIDE
(7E)N(4chlorophenyl)7(4fluorobenzylidene)3(4fluorophenyl)33a4567hexahydro2Hindazole2carboxamide
6058923
InChI=1SC27H22ClF2N3Oc282081423(15920)3127(34)3326(1861222(30)13718)2431219(25(24)3233)161741021(29)11517h4162426H13H2(H3134)b1916+
MFCD03489677
ZINC000012494096
ZINC000012494124
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