Vitas-M small molecule compound
[(7E)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](pyridin-2-yl)methanone
Catalog ID
STK009159
SMILES Clc1ccc(cc1)/C=C/1\CCCC2C1=NN(C2c1ccc(cc1)Cl)C(=O)c1ccccn1
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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 C26H21Cl2N3O MW 462.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N3O/c27-20-11-7-17(8-12-20)16-19-4-3-5-22-24(19)30-31(26(32)23-6-1-2-15-29-23)25(22)18-9-13-21(28)14-10-18/h1-2,6-16,22,25H,3-5H2/b19-16+InChIKey
NTNGQELQUNURAO-KNTRCKAVSA-NSynonyms
((7E)3(4CHLOROPHENYL)7((4CHLOROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)PYRIDIN2YLMETHANONE
((7E)7(4chlorobenzylidene)3(4chlorophenyl)33a4567hexahydro2Hindazol2yl)(pyridin2yl)methanone
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Cl)C1)C(=O)C4=CC=CC=N4)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)C=C1CCCC2C1=NN(C2c1ccc(cc1)Cl)C(=O)c1ccccn1
InChI=1SC26H21Cl2N3Oc272011717(81220)16194352224(19)3031(26(32)23612152923)25(22)1891321(28)141018h126162225H35H2b1916+
MFCD01627305
STK009159
ZINC000008958900
ZINC000012285425
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