Vitas-M small molecule compound
ethyl 2-{[(4,5-dibromothiophen-2-yl)carbonyl]amino}-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate
Catalog ID
STK449853
SMILES CCOC(=O)c1c(NC(=O)c2sc(c(c2)Br)Br)sc2c1CCCCCCCCCCC2
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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 C23H29Br2NO3S2 MW 591.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29Br2NO3S2/c1-2-29-23(28)19-15-12-10-8-6-4-3-5-7-9-11-13-17(15)31-22(19)26-21(27)18-14-16(24)20(25)30-18/h14H,2-13H2,1H3,(H,26,27)InChIKey
BIXILAYNDLLVQO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCCCCCCC2)NC(=O)C3=CC(=C(S3)Br)Br
ethyl15((45dibromothiophene2carbonyl)amino)14thiabicyclo(1130)hexadeca1(13)15diene16carboxylate
ethyl2(((45dibromothiophen2yl)carbonyl)amino)567891011121314decahydro4Hcyclotrideca(b)thiophene3carboxylate
InChI=1SC23H29Br2NO3S2c122923(28)191512108643579111317(15)3122(19)2621(27)181416(24)20(25)3018h14H213H21H3(H2627)
MFCD03467317
ZINC000097948663
ZINC97948663
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