Vitas-M small molecule compound
propyl 5-(dimethylcarbamoyl)-2-[(4-{[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butanoyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK340321
SMILES CCCOC(=O)c1c(NC(=O)CCCS(=O)(=O)c2nc(cc(n2)C(F)(F)F)c2ccccc2OC)sc(c1C)C(=O)N(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 C28H31F3N4O7S2 MW 656.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31F3N4O7S2/c1-6-13-42-26(38)22-16(2)23(25(37)35(3)4)43-24(22)34-21(36)12-9-14-44(39,40)27-32-18(15-20(33-27)28(29,30)31)17-10-7-8-11-19(17)41-5/h7-8,10-11,15H,6,9,12-14H2,1-5H3,(H,34,36)InChIKey
VMMFBBPSXKQBBL-UHFFFAOYSA-NSynonyms
685527-02-0685527020
CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CCCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3OC
InChI=1SC28H31F3N4O7S2c16134226(38)2216(2)23(25(37)35(3)4)4324(22)3421(36)1291444(3940)273218(1520(3327)28(2930)31)1710781119(17)415h78101115H691214H215H3(H3436)
MFCD06164160
propyl5(dimethylcarbamoyl)2((4((4(2methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonyl)butanoyl)amino)4methylthiophene3carboxylate
propyl5(dimethylcarbamoyl)2(4(4(2methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonylbutanoylamino)4methylthiophene3carboxylate
PROPYL5(NNDIMETHYLCARBAMOYL)2(4((6(2METHOXYPHENYL)4(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFONYL)BUTANOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000098043143
ZINC98043143
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.