Vitas-M small molecule compound

ethyl 2-[(chloroacetyl)amino]-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK042778
SMILES CCOC(=O)c1c(NC(=O)CCl)sc(c1C)C(=O)NC1CCCCC1

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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 C17H23ClN2O4S MW 386.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23ClN2O4S/c1-3-24-17(23)13-10(2)14(25-16(13)20-12(21)9-18)15(22)19-11-7-5-4-6-8-11/h11H,3-9H2,1-2H3,(H,19,22)(H,20,21)
InChIKey
FPFHIQMAKJQPDJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)CCl
CCOC(=O)c1c(NC(=O)CCl)sc(c1C)C(=O)NC1CCCCC1
ETHYL2((2CHLOROACETYL)AMINO)5(CYCLOHEXYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((CHLOROACETYL)AMINO)5(CYCLOHEXYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2CHLOROACETYLAMINO)5(NCYCLOHEXYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC17H23ClN2O4Sc132417(23)1310(2)14(2516(13)2012(21)918)15(22)19117546811h11H39H212H3(H1922)(H2021)
MFCD03312467
STK042778
ZINC000002762254
ZINC02762254
ZINC2762254

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Available files

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