Vitas-M small molecule compound
6-{[3-(ethoxycarbonyl)-4-phenylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK453669
SMILES CCOC(=O)c1c(scc1c1ccccc1)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 C21H21NO5S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5S/c1-2-27-21(26)17-16(13-8-4-3-5-9-13)12-28-19(17)22-18(23)14-10-6-7-11-15(14)20(24)25/h3-9,12,14-15H,2,10-11H2,1H3,(H,22,23)(H,24,25)InChIKey
YHJJHYNPKSYASF-UHFFFAOYSA-NSynonyms
6((3(ethoxycarbonyl)4phenylthiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3ETHOXYCARBONYL4PHENYLTHIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(3(ETHOXYCARBONYL)4PHENYL2THIENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC21H21NO5Sc122721(26)1716(138435913)122819(17)2218(23)1410671115(14)20(24)25h39121415H21011H21H3(H2223)(H2425)
MFCD02254720
ZINC000002763214
ZINC000002763217
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