Vitas-M small molecule compound
3-{[4-(4-ethylphenyl)-3-(methoxycarbonyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STL504391
SMILES COC(=O)c1c(scc1c1ccc(cc1)CC)NC(=O)C1C2C=CC(C1C(=O)O)C2
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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 C23H23NO5S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO5S/c1-3-12-4-6-13(7-5-12)16-11-30-21(19(16)23(28)29-2)24-20(25)17-14-8-9-15(10-14)18(17)22(26)27/h4-9,11,14-15,17-18H,3,10H2,1-2H3,(H,24,25)(H,26,27)InChIKey
KLEXWUKVTQVXEO-UHFFFAOYSA-NSynonyms
17383998
3((4(4ethylphenyl)3(methoxycarbonyl)thiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3((4(4ethylphenyl)3methoxycarbonylthiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(4(4ETHYLPHENYL)3(METHOXYCARBONYL)2THIENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
InChI=1SC23H23NO5Sc13124613(7512)16113021(19(16)23(28)292)2420(25)17148915(1014)18(17)22(26)27h491114151718H310H212H3(H2425)(H2627)
MFCD07593918
ZINC000102404839
ZINC000245239557
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