Vitas-M small molecule compound
[(7E)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](2-chlorophenyl)methanone
Catalog ID
STK889127
SMILES Clc1ccc(cc1)/C=C/1\CCCC2C1=NN(C2c1ccc(cc1)Cl)C(=O)c1ccccc1Cl
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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 C27H21Cl3N2O MW 495.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21Cl3N2O/c28-20-12-8-17(9-13-20)16-19-4-3-6-23-25(19)31-32(26(23)18-10-14-21(29)15-11-18)27(33)22-5-1-2-7-24(22)30/h1-2,5,7-16,23,26H,3-4,6H2/b19-16+InChIKey
ANQRRKYSSTVYHH-KNTRCKAVSA-NSynonyms
((7E)7(4chlorobenzylidene)3(4chlorophenyl)33a4567hexahydro2Hindazol2yl)(2chlorophenyl)methanone
(2CHLOROPHENYL)((7E)3(4CHLOROPHENYL)7((4CHLOROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)METHANONE
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Cl)C1)C(=O)C4=CC=CC=C4Cl)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)C=C1CCCC2C1=NN(C2c1ccc(cc1)Cl)C(=O)c1ccccc1Cl
InChI=1SC27H21Cl3N2Oc282012817(91320)16194362325(19)3132(26(23)18101421(29)151118)27(33)22512724(22)30h1257162326H346H2b1916+
MFCD01416449
ZINC000008431554
ZINC000008431558
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