Vitas-M small molecule compound
6-tert-butyl-2-{[(E)-(3-fluorophenyl)methylidene]amino}-N-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385167
SMILES Fc1cccc(c1)/C=N/c1sc2c(c1C(=O)Nc1cccc(c1)C(F)(F)F)CCC(C2)C(C)(C)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 C27H26F4N2OS MW 502.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F4N2OS/c1-26(2,3)17-10-11-21-22(14-17)35-25(32-15-16-6-4-8-19(28)12-16)23(21)24(34)33-20-9-5-7-18(13-20)27(29,30)31/h4-9,12-13,15,17H,10-11,14H2,1-3H3,(H,33,34)/b32-15+InChIKey
GQJXOSMTVVHMPZ-VWJSQJICSA-NSynonyms
6tertbutyl2(((E)(3fluorophenyl)methylidene)amino)N(3(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((E)(3fluorophenyl)methylideneamino)N(3(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC(=C3)C(F)(F)F)N=CC4=CC(=CC=C4)F
Fc1cccc(c1)C=Nc1sc2c(c1C(=O)Nc1cccc(c1)C(F)(F)F)CCC(C2)C(C)(C)C
InChI=1SC27H26F4N2OSc126(23)1710112122(1417)3525(32151664819(28)1216)23(21)24(34)332095718(1320)27(2930)31h4912131517H101114H213H3(H3334)b3215+
MFCD03274043
ZINC000015946501
ZINC000015946502
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