Vitas-M small molecule compound
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-[(7E)-3-(thiophen-2-yl)-7-(thiophen-2-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]ethanone
Catalog ID
STK302159
SMILES O=C(N1N=C2C(C1c1cccs1)CCC/C/2=C\c1cccs1)Cn1nc(cc1C)C(F)(F)F
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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 C23H21F3N4OS2 MW 490.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N4OS2/c1-14-11-19(23(24,25)26)27-29(14)13-20(31)30-22(18-8-4-10-33-18)17-7-2-5-15(21(17)28-30)12-16-6-3-9-32-16/h3-4,6,8-12,17,22H,2,5,7,13H2,1H3/b15-12+InChIKey
GBBJXBASWHMJCA-NTCAYCPXSA-NSynonyms
512816-13-62(5methyl3(trifluoromethyl)1Hpyrazol1yl)1((7E)3(thiophen2yl)7(thiophen2ylmethylidene)33a4567hexahydro2Hindazol2yl)ethanone
2(5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)1((7E)3THIOPHEN2YL7(THIOPHEN2YLMETHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)ETHANONE
512816136
CC1=CC(=NN1CC(=O)N2C(C3CCCC(=CC4=CC=CS4)C3=N2)C5=CC=CS5)C(F)(F)F
InChI=1SC23H21F3N4OS2c1141119(23(2425)26)2729(14)1320(31)3022(1884103318)1772515(21(17)2830)12166393216h3468121722H25713H21H3b1512+
MFCD03467375
O=C(N1N=C2C(C1c1cccs1)CCCC2=Cc1cccs1)Cn1nc(cc1C)C(F)(F)F
ZINC000008455556
ZINC000008455559
Check stock
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