Vitas-M small molecule compound
(7E)-7-benzylidene-N-(3-chlorophenyl)-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carboxamide
Catalog ID
STL509178
SMILES Clc1cccc(c1)NC(=O)N1N=C2C(C1c1ccccc1)CCC/C/2=C\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 C27H24ClN3O MW 441.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN3O/c28-22-14-8-15-23(18-22)29-27(32)31-26(20-11-5-2-6-12-20)24-16-7-13-21(25(24)30-31)17-19-9-3-1-4-10-19/h1-6,8-12,14-15,17-18,24,26H,7,13,16H2,(H,29,32)/b21-17+InChIKey
OFMWAWUPRBPOOI-HEHNFIMWSA-NSynonyms
(7~(E))7benzylidene~(N)(3chlorophenyl)3phenyl3~(a)456tetrahydro3~(H)indazole2carboxamide
(7E)7benzylideneN(3chlorophenyl)3phenyl33a4567hexahydro2Hindazole2carboxamide
134612711
InChI=1SC27H24ClN3Oc28221481523(1822)2927(32)3126(20115261220)241671321(25(24)3031)171993141019h16812141517182426H71316H2(H2932)b2117+
MFCD03489678
ZINC000108913088
ZINC001505534845
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