Vitas-M small molecule compound
ethyl 2-{[(5-chloro-2-methoxyphenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK448870
SMILES CCOC(=O)c1c(NC(=O)c2cc(Cl)ccc2OC)sc2c1CCCCC2
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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 C20H22ClNO4S MW 407.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO4S/c1-3-26-20(24)17-13-7-5-4-6-8-16(13)27-19(17)22-18(23)14-11-12(21)9-10-15(14)25-2/h9-11H,3-8H2,1-2H3,(H,22,23)InChIKey
YHIOVEFBZOKWNB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=C(C=CC(=C3)Cl)OC
ethyl2(((5chloro2methoxyphenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((5chloro2methoxybenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H22ClNO4Sc132620(24)17137546816(13)2719(17)2218(23)141112(21)91015(14)252h911H38H212H3(H2223)
MFCD01345689
ZINC000000995363
ZINC00995363
ZINC995363
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