Vitas-M small molecule compound

methyl 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-3-methylthiophene-2-carboxylate

Catalog ID
STK248081
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)COc1ccc(cc1C)Cl

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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 C17H15ClN2O4S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2O4S/c1-9-6-11(18)4-5-13(9)24-8-14(21)20-16-12(7-19)10(2)15(25-16)17(22)23-3/h4-6H,8H2,1-3H3,(H,20,21)
InChIKey
UXMFKXVLPXQVQU-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N
InChI=1SC17H15ClN2O4Sc19611(18)4513(9)24814(21)201612(719)10(2)15(2516)17(22)233h46H8H213H3(H2021)
methyl5(((4chloro2methylphenoxy)acetyl)amino)4cyano3methylthiophene2carboxylate
METHYL5((2(4CHLORO2METHYLPHENOXY)ACETYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
METHYL5(2(4CHLORO2METHYLPHENOXY)ACETYLAMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
MFCD03243708
ZINC000004454693
ZINC04454693
ZINC4454693

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Available files

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