Vitas-M small molecule compound

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

Catalog ID
STK070064
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccc(c(c1)Cl)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 C24H22Cl2N2O5S MW 521.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Cl2N2O5S/c1-4-32-24(31)20-14(3)21(22(30)27-16-8-5-13(2)18(26)11-16)34-23(20)28-19(29)12-33-17-9-6-15(25)7-10-17/h5-11H,4,12H2,1-3H3,(H,27,30)(H,28,29)
InChIKey
JKRZVRAZXFIPKL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=C(C=C2)C)Cl)NC(=O)COC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccc(c(c1)Cl)C
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)2(((4CHLOROPHENOXY)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)2((2(4CHLOROPHENOXY)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLORO4METHYLPHENYL)CARBAMOYL)2(2(4CHLOROPHENOXY)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H22Cl2N2O5Sc143224(31)2014(3)21(22(30)27168513(2)18(26)1116)3423(20)2819(29)1233179615(25)71017h511H412H213H3(H2730)(H2829)
MFCD02627430
STK070064
ZINC000002788670
ZINC02788670
ZINC2788670

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Available files

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