Vitas-M small molecule compound
(7E)-N-cyclohexyl-7-(4-methoxybenzylidene)-3-(4-methoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carboxamide
Catalog ID
STK889290
SMILES COc1ccc(cc1)/C=C/1\CCCC2C1=NN(C2c1ccc(cc1)OC)C(=O)NC1CCCCC1
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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 C29H35N3O3 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35N3O3/c1-34-24-15-11-20(12-16-24)19-22-7-6-10-26-27(22)31-32(29(33)30-23-8-4-3-5-9-23)28(26)21-13-17-25(35-2)18-14-21/h11-19,23,26,28H,3-10H2,1-2H3,(H,30,33)/b22-19+InChIKey
ZHUORPBOROGVBD-ZBJSNUHESA-NSynonyms
(7E)NCYCLOHEXYL3(4METHOXYPHENYL)7((4METHOXYPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOLE2CARBOXAMIDE
(7E)Ncyclohexyl7(4methoxybenzylidene)3(4methoxyphenyl)33a4567hexahydro2Hindazole2carboxamide
COC1=CC=C(C=C1)C=C2CCCC3C2=NN(C3C4=CC=C(C=C4)OC)C(=O)NC5CCCCC5
InChI=1SC29H35N3O3c13424151120(121624)192276102627(22)3132(29(33)30238435923)28(26)21131725(352)181421h1119232628H310H212H3(H3033)b2219+
MFCD03489672
ZINC000033712335
ZINC000038306654
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