Vitas-M small molecule compound

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

Catalog ID
STK055834
SMILES CCOC(=O)c1c(NC(=O)Cc2ccc(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 C24H19Cl2F3N2O4S MW 559.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Cl2F3N2O4S/c1-3-35-23(34)19-12(2)20(21(33)30-17-11-14(24(27,28)29)6-9-16(17)26)36-22(19)31-18(32)10-13-4-7-15(25)8-5-13/h4-9,11H,3,10H2,1-2H3,(H,30,33)(H,31,32)
InChIKey
HFGRCSKPMUFWPN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)NC(=O)CC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1cc(ccc1Cl)C(F)(F)F
ETHYL2(((4CHLOROPHENYL)ACETYL)AMINO)5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2(4CHLOROPHENYL)ACETYL)AMINO)5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2(4CHLOROPHENYL)ACETYLAMINO)5(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H19Cl2F3N2O4Sc133523(34)1912(2)20(21(33)30171114(24(2728)29)6916(17)26)3622(19)3118(32)10134715(25)8513h4911H310H212H3(H3033)(H3132)
MFCD01874258
STK055834
ZINC000100098800
ZINC100098800

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Available files

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