Vitas-M small molecule compound
(7Z)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-2-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole
Catalog ID
STK993697
SMILES Clc1ccc(cc1)C1C2CCC/C(=C/c3ccc(cc3)Cl)/C2=NN1c1ccc(cc1)[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 C26H21Cl2N3O2 MW 478.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N3O2/c27-20-8-4-17(5-9-20)16-19-2-1-3-24-25(19)29-30(22-12-14-23(15-13-22)31(32)33)26(24)18-6-10-21(28)11-7-18/h4-16,24,26H,1-3H2/b19-16-InChIKey
VDZWVYFOJVXKQV-MNDPQUGUSA-NSynonyms
(7Z)3(4chlorophenyl)7((4chlorophenyl)methylidene)2(4nitrophenyl)3a456tetrahydro3Hindazole
(7Z)7(4chlorobenzylidene)3(4chlorophenyl)2(4nitrophenyl)33a4567hexahydro2Hindazole
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Cl)C1)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Cl
Clc1ccc(cc1)C1C2CCCC(=Cc3ccc(cc3)Cl)C2=NN1c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H21Cl2N3O2c27208417(5920)16192132425(19)2930(22121423(151322)31(32)33)26(24)1861021(28)11718h4162426H13H2b1916
MFCD18184968
ZINC000051330308
ZINC000051330313
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