Vitas-M small molecule compound
propan-2-yl 6-methyl-2-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL396961
SMILES CC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)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 C20H24F3N3O3S MW 443.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24F3N3O3S/c1-10(2)29-19(28)17-13-6-5-11(3)7-14(13)30-18(17)24-16(27)9-26-12(4)8-15(25-26)20(21,22)23/h8,10-11H,5-7,9H2,1-4H3,(H,24,27)InChIKey
DPOAXDFPWPJHPS-UHFFFAOYSA-NSynonyms
489407-95-6489407956
CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)CN3C(=CC(=N3)C(F)(F)F)C
InChI=1SC20H24F3N3O3Sc110(2)2919(28)17136511(3)714(13)3018(17)2416(27)92612(4)815(2526)20(2122)23h81011H579H214H3(H2427)
MFCD01834575
propan2yl6methyl2(((5methyl3(trifluoromethyl)1Hpyrazol1yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl6methyl2((2(5methyl3(trifluoromethyl)pyrazol1yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000000997650
ZINC000002742361
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