Vitas-M small molecule compound
6-{[3-(ethoxycarbonyl)-4-(4-fluorophenyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK423911
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)C1CC=CCC1C(=O)O
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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 C21H20FNO5S MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FNO5S/c1-2-28-21(27)17-16(12-7-9-13(22)10-8-12)11-29-19(17)23-18(24)14-5-3-4-6-15(14)20(25)26/h3-4,7-11,14-15H,2,5-6H2,1H3,(H,23,24)(H,25,26)InChIKey
YHQQZTIVNVWNBT-UHFFFAOYSA-NSynonyms
350999-74-5(1R6R)6((3(ETHOXYCARBONYL)4(4FLUOROPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
(1R6S)6((3(ETHOXYCARBONYL)4(4FLUOROPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
(1S6R)6((3(ETHOXYCARBONYL)4(4FLUOROPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
350999745
6(((3(ETHOXYCARBONYL)4(4FLUOROPHENYL)2THIENYL)AMINO)CARBONYL)3CYCLOHEXENE1CARBOXYLICACID
6((3(ethoxycarbonyl)4(4fluorophenyl)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3ETHOXYCARBONYL4(4FLUOROPHENYL)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(3(ETHOXYCARBONYL)4(4FLUOROPHENYL)2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC21H20FNO5Sc122821(27)1716(127913(22)10812)112919(17)2318(24)14534615(14)20(25)26h347111415H256H21H3(H2324)(H2526)
MFCD01993793
ZINC000005094777
ZINC000005094780
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