Vitas-M small molecule compound

ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-{[(2-fluorophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK045428
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(c(c1)Cl)C)NC(=O)c1ccccc1F

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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 C23H20ClFN2O4S MW 474.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClFN2O4S/c1-4-31-23(30)18-13(3)19(21(29)26-14-10-9-12(2)16(24)11-14)32-22(18)27-20(28)15-7-5-6-8-17(15)25/h5-11H,4H2,1-3H3,(H,26,29)(H,27,28)
InChIKey
ATYYTURRZIIQBD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=C(C=C2)C)Cl)NC(=O)C3=CC=CC=C3F
CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(c(c1)Cl)C)NC(=O)c1ccccc1F
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)2(((2FLUOROPHENYL)CARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)2((2FLUOROBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLORO4METHYLPHENYL)CARBAMOYL)2((2FLUOROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H20ClFN2O4Sc143123(30)1813(3)19(21(29)261410912(2)16(24)1114)3222(18)2720(28)15756817(15)25h511H4H213H3(H2629)(H2728)
MFCD02627431
STK045428
ZINC000008926477
ZINC08926477
ZINC8926477

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Available files

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