Vitas-M small molecule compound
(7Z)-7-(4-methylbenzylidene)-3-(4-methylphenyl)-2-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
Catalog ID
STK993711
SMILES Cc1ccc(cc1)/C=C\1/CCCC2C1=NN(C2c1ccc(cc1)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 C28H28N2 MW 392.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2/c1-20-11-15-22(16-12-20)19-24-7-6-10-26-27(24)29-30(25-8-4-3-5-9-25)28(26)23-17-13-21(2)14-18-23/h3-5,8-9,11-19,26,28H,6-7,10H2,1-2H3/b24-19-InChIKey
LKLUMFVPFBRWSF-CLCOLTQESA-NSynonyms
(7Z)3(4methylphenyl)7((4methylphenyl)methylidene)2phenyl3a456tetrahydro3Hindazole
(7Z)7(4methylbenzylidene)3(4methylphenyl)2phenyl33a4567hexahydro2Hindazole
CC1=CC=C(C=C1)C=C2CCCC3C2=NN(C3C4=CC=C(C=C4)C)C5=CC=CC=C5
Cc1ccc(cc1)C=C1CCCC2C1=NN(C2c1ccc(cc1)C)c1ccccc1
InChI=1SC28H28N2c120111522(161220)192476102627(24)2930(258435925)28(26)23171321(2)141823h358911192628H6710H212H3b2419
MFCD18184980
ZINC000051330357
ZINC000051330362
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