Vitas-M small molecule compound
6-{[4-(2,5-dimethylphenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK316757
SMILES CCOC(=O)c1c(NC(=O)C2CC=CCC2C(=O)O)sc(c1c1cc(C)ccc1C)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 C24H27NO5S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5S/c1-5-30-24(29)20-19(18-12-13(2)10-11-14(18)3)15(4)31-22(20)25-21(26)16-8-6-7-9-17(16)23(27)28/h6-7,10-12,16-17H,5,8-9H2,1-4H3,(H,25,26)(H,27,28)InChIKey
ANEYESKHPUSPOS-UHFFFAOYSA-NSynonyms
445002-66-4445002664
6(((4(25DIMETHYLPHENYL)3(ETHOXYCARBONYL)5METHYLTHIEN2YL)AMINO)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
6((4(25dimethylphenyl)3(ethoxycarbonyl)5methylthiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((4(25DIMETHYLPHENYL)3ETHOXYCARBONYL5METHYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
CCOC(=O)C1=C(SC(=C1C2=C(C=CC(=C2)C)C)C)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC24H27NO5Sc153024(29)2019(181213(2)101114(18)3)15(4)3122(20)2521(26)16867917(16)23(27)28h6710121617H589H214H3(H2526)(H2728)
MFCD02255342
ZINC000003864237
ZINC000003864240
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