Vitas-M small molecule compound

ethyl 5-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}-4-methyl-2-{[(3-methylphenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK090269
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)C)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 C24H20ClF3N2O4S MW 524.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClF3N2O4S/c1-4-34-23(33)18-13(3)19(35-22(18)30-20(31)14-7-5-6-12(2)10-14)21(32)29-17-11-15(24(26,27)28)8-9-16(17)25/h5-11H,4H2,1-3H3,(H,29,32)(H,30,31)
InChIKey
WCURZRZBWURETA-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(=CC=C3)C
CCOC(=O)c1c(NC(=O)c2cccc(c2)C)sc(c1C)C(=O)Nc1cc(ccc1Cl)C(F)(F)F
ETHYL5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYL2(((3METHYLPHENYL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYL2((3METHYLBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)4METHYL2((3METHYLPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC24H20ClF3N2O4Sc143423(33)1813(3)19(3522(18)3020(31)1475612(2)1014)21(32)29171115(24(2627)28)8916(17)25h511H4H213H3(H2932)(H3031)
MFCD01874267
STK090269
ZINC000059844758
ZINC59844758

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Available files

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