Vitas-M small molecule compound

ethyl 5-acetyl-2-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-4-methylthiophene-3-carboxylate

Catalog ID
STK426840
SMILES CCOC(=O)c1c(NC(=O)C2CC3CC2CC3)sc(c1C)C(=O)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 C18H23NO4S MW 349.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO4S/c1-4-23-18(22)14-9(2)15(10(3)20)24-17(14)19-16(21)13-8-11-5-6-12(13)7-11/h11-13H,4-8H2,1-3H3,(H,19,21)
InChIKey
JXGYABLSUPRAQA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2CC3CCC2C3
ethyl5acetyl2((bicyclo(221)hept2ylcarbonyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(BICYCLO(221)HEPT2YLCARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5ACETYL2(BICYCLO(221)HEPTANE3CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC18H23NO4Sc142318(22)149(2)15(10(3)20)2417(14)1916(21)138115612(13)711h1113H48H213H3(H1921)
MFCD01354769
ZINC000102607565
ZINC000102607567

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Available files

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