Vitas-M small molecule compound
[(7E)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](2-chloro-5-nitrophenyl)methanone
Catalog ID
STK889219
SMILES CC1C/C(=C\c2ccc(cc2)Cl)/C2=NN(C(C2C1)c1ccc(cc1)Cl)C(=O)c1cc(ccc1Cl)[N+](=O)[O-]
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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 C28H22Cl3N3O3 MW 554.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl3N3O3/c1-16-12-19(14-17-2-6-20(29)7-3-17)26-24(13-16)27(18-4-8-21(30)9-5-18)33(32-26)28(35)23-15-22(34(36)37)10-11-25(23)31/h2-11,14-16,24,27H,12-13H2,1H3/b19-14+InChIKey
NCHSUHDONALJLJ-XMHGGMMESA-NSynonyms
((7E)7(4chlorobenzylidene)3(4chlorophenyl)5methyl33a4567hexahydro2Hindazol2yl)(2chloro5nitrophenyl)methanone
(2CHLORO5NITROPHENYL)((7E)3(4CHLOROPHENYL)7((4CHLOROPHENYL)METHYLIDENE)5METHYL3A456TETRAHYDRO3HINDAZOL2YL)METHANONE
CC1CC(=Cc2ccc(cc2)Cl)C2=NN(C(C2C1)c1ccc(cc1)Cl)C(=O)c1cc(ccc1Cl)(N+)(=O)(O)
CC1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Cl)C1)C(=O)C4=C(C=CC(=C4)(N+)(=O)(O))Cl)C5=CC=C(C=C5)Cl
InChI=1SC28H22Cl3N3O3c1161219(14172620(29)7317)2624(1316)27(184821(30)9518)33(3226)28(35)231522(34(36)37)101125(23)31h21114162427H1213H21H3b1914+
MFCD02705818
ZINC000102928552
ZINC000245311313
Check stock
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