Vitas-M small molecule compound
[(7E)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl][3-nitro-4-(piperidin-1-yl)phenyl]methanone
Catalog ID
STL286823
SMILES CC1C/C(=C\c2ccc(cc2)Cl)/C2=NN(C(C2C1)c1ccc(cc1)Cl)C(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1
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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 C33H32Cl2N4O3 MW 603.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32Cl2N4O3/c1-21-17-25(19-22-5-10-26(34)11-6-22)31-28(18-21)32(23-7-12-27(35)13-8-23)38(36-31)33(40)24-9-14-29(30(20-24)39(41)42)37-15-3-2-4-16-37/h5-14,19-21,28,32H,2-4,15-18H2,1H3/b25-19+InChIKey
JJSRVEBOAMBHPD-NCELDCMTSA-NSynonyms
((7E)3(4CHLOROPHENYL)7((4CHLOROPHENYL)METHYLIDENE)5METHYL3A456TETRAHYDRO3HINDAZOL2YL)(3NITRO4PIPERIDIN1YLPHENYL)METHANONE
((7E)7(4chlorobenzylidene)3(4chlorophenyl)5methyl33a4567hexahydro2Hindazol2yl)(3nitro4(piperidin1yl)phenyl)methanone
CC1CC(=Cc2ccc(cc2)Cl)C2=NN(C(C2C1)c1ccc(cc1)Cl)C(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCCC1
CC1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Cl)C1)C(=O)C4=CC(=C(C=C4)N5CCCCC5)(N+)(=O)(O))C6=CC=C(C=C6)Cl
InChI=1SC33H32Cl2N4O3c1211725(192251026(34)11622)3128(1821)32(2371227(35)13823)38(3631)33(40)2491429(30(2024)39(41)42)37153241637h51419212832H241518H21H3b2519+
MFCD02704732
ZINC000097971273
ZINC000245310655
Check stock
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