Vitas-M small molecule compound
ethyl 2-{[(3-methoxyphenyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK438990
SMILES CCOC(=O)c1c(NC(=S)Nc2cccc(c2)OC)sc2c1CCCCCC2
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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 C21H26N2O3S2 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3S2/c1-3-26-20(24)18-16-11-6-4-5-7-12-17(16)28-19(18)23-21(27)22-14-9-8-10-15(13-14)25-2/h8-10,13H,3-7,11-12H2,1-2H3,(H2,22,23,27)InChIKey
UZVHBTLDFULICK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NC3=CC(=CC=C3)OC
ethyl2(((3methoxyphenyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((3methoxyphenyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC21H26N2O3S2c132620(24)18161164571217(16)2819(18)2321(27)2214981015(1314)252h81013H371112H212H3(H2222327)
MFCD03945855
ZINC000005948052
ZINC05948052
ZINC5948052
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Check stock on Vitas-MAvailable files
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