Vitas-M small molecule compound

ethyl 2-{[(4-chlorophenyl)carbonyl]amino}-5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate

Catalog ID
STK005250
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C(=O)Nc1cc(ccc1Cl)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 C23H17Cl2F3N2O4S MW 545.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2F3N2O4S/c1-3-34-22(33)17-11(2)18(35-21(17)30-19(31)12-4-7-14(24)8-5-12)20(32)29-16-10-13(23(26,27)28)6-9-15(16)25/h4-10H,3H2,1-2H3,(H,29,32)(H,30,31)
InChIKey
GCWFXLHOHZEECL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)NC(=O)C3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C(=O)Nc1cc(ccc1Cl)C(F)(F)F
ETHYL2(((4CHLOROPHENYL)CARBONYL)AMINO)5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROPHENYL)CARBONYLAMINO)5(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H17Cl2F3N2O4Sc133422(33)1711(2)18(3521(17)3019(31)124714(24)8512)20(32)29161013(23(2627)28)6915(16)25h410H3H212H3(H2932)(H3031)
MFCD01874255
STK005250
ZINC000002757388
ZINC2757388

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.