Vitas-M small molecule compound

3-{[3-(ethoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK425527
SMILES CCOC(=O)c1cc(sc1NC(=O)C1C2CCC(C1C(=O)O)O2)CCC

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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 C18H23NO6S MW 381.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO6S/c1-3-5-9-8-10(18(23)24-4-2)16(26-9)19-15(20)13-11-6-7-12(25-11)14(13)17(21)22/h8,11-14H,3-7H2,1-2H3,(H,19,20)(H,21,22)
InChIKey
WZHXSPWZDFLGBW-UHFFFAOYSA-N
Synonyms

2((3ETHOXYCARBONYL5PROPYLTHIOPHEN2YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3((3(ethoxycarbonyl)5propylthiophen2yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(3(ETHOXYCARBONYL)5PROPYL2THIENYL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CCCC1=CC(=C(S1)NC(=O)C2C3CCC(C2C(=O)O)O3)C(=O)OCC
InChI=1SC18H23NO6Sc1359810(18(23)2442)16(269)1915(20)13116712(2511)14(13)17(21)22h81114H37H212H3(H1920)(H2122)
MFCD02375201
ZINC000138680639
ZINC000225627990

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Available files

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