Vitas-M small molecule compound
1-{2-[(7E)-7-(2-chlorobenzylidene)-3-(2-chlorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-4-methyl-1,3-thiazol-5-yl}ethanone
Catalog ID
STK993731
SMILES Clc1ccccc1C1C2CCC/C(=C\c3ccccc3Cl)/C2=NN1c1sc(c(n1)C)C(=O)C
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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 C26H23Cl2N3OS MW 496.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N3OS/c1-15-25(16(2)32)33-26(29-15)31-24(19-10-4-6-13-22(19)28)20-11-7-9-18(23(20)30-31)14-17-8-3-5-12-21(17)27/h3-6,8,10,12-14,20,24H,7,9,11H2,1-2H3/b18-14+InChIKey
TVUDQEUXLLGPQC-NBVRZTHBSA-NSynonyms
1(2((7E)3(2CHLOROPHENYL)7((2CHLOROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)4METHYL13THIAZOL5YL)ETHANONE
1(2((7E)7(2chlorobenzylidene)3(2chlorophenyl)33a4567hexahydro2Hindazol2yl)4methyl13thiazol5yl)ethanone
CC1=C(SC(=N1)N2C(C3CCCC(=CC4=CC=CC=C4Cl)C3=N2)C5=CC=CC=C5Cl)C(=O)C
Clc1ccccc1C1C2CCCC(=Cc3ccccc3Cl)C2=NN1c1sc(c(n1)C)C(=O)C
InChI=1SC26H23Cl2N3OSc11525(16(2)32)3326(2915)3124(1910461322(19)28)20117918(23(20)3031)14178351221(17)27h3681012142024H7911H212H3b1814+
MFCD02725539
ZINC000012500677
ZINC000012500689
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