Vitas-M small molecule compound
3-{[3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK423443
SMILES CCOC(=O)c1cc(sc1NC(=O)C1C2CCC(C1C(=O)O)C2)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 C17H21NO5S MW 351.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO5S/c1-3-23-17(22)11-6-8(2)24-15(11)18-14(19)12-9-4-5-10(7-9)13(12)16(20)21/h6,9-10,12-13H,3-5,7H2,1-2H3,(H,18,19)(H,20,21)InChIKey
OMKVUZTWFUHSOQ-UHFFFAOYSA-NSynonyms
2((3ETHOXYCARBONYL5METHYLTHIOPHEN2YL)CARBAMOYL)BICYCLO(221)HEPTANE3CARBOXYLICACID
3((3(ethoxycarbonyl)5methylthiophen2yl)carbamoyl)bicyclo(221)heptane2carboxylicacid
3(N(3(ETHOXYCARBONYL)5METHYL2THIENYL)CARBAMOYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2C3CCC(C3)C2C(=O)O
InChI=1SC17H21NO5Sc132317(22)1168(2)2415(11)1814(19)1294510(79)13(12)16(20)21h69101213H357H212H3(H1819)(H2021)
MFCD02176726
ZINC000102186029
ZINC000138668523
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