Vitas-M small molecule compound

6-{[4-(4-fluorophenyl)-5-methyl-3-(propoxycarbonyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK317111
SMILES CCCOC(=O)c1c(NC(=O)C2CC=CCC2C(=O)O)sc(c1c1ccc(cc1)F)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 C23H24FNO5S MW 445.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24FNO5S/c1-3-12-30-23(29)19-18(14-8-10-15(24)11-9-14)13(2)31-21(19)25-20(26)16-6-4-5-7-17(16)22(27)28/h4-5,8-11,16-17H,3,6-7,12H2,1-2H3,(H,25,26)(H,27,28)
InChIKey
FJZXXBLABJKWAW-UHFFFAOYSA-N
Synonyms
524928-14-1
524928141
6(((4(4FLUOROPHENYL)5METHYL3(PROPOXYCARBONYL)THIEN2YL)AMINO)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
6((4(4fluorophenyl)5methyl3(propoxycarbonyl)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((4(4FLUOROPHENYL)5METHYL3PROPOXYCARBONYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)F)C)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC23H24FNO5Sc13123023(29)1918(1481015(24)11914)13(2)3121(19)2520(26)16645717(16)22(27)28h458111617H36712H212H3(H2526)(H2728)
MFCD02177059
ZINC000002764810
ZINC000002764813

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Available files

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