Vitas-M small molecule compound
ethyl 5-[({5-[(4-bromophenoxy)methyl]furan-2-yl}carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate
Catalog ID
STL173832
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc(o1)COc1ccc(cc1)Br
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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 C21H17BrN2O5S MW 489.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O5S/c1-3-27-21(26)18-12(2)16(10-23)20(30-18)24-19(25)17-9-8-15(29-17)11-28-14-6-4-13(22)5-7-14/h4-9H,3,11H2,1-2H3,(H,24,25)InChIKey
PIVPBLIGAUCEDH-UHFFFAOYSA-NSynonyms
828286-57-3828286573
CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)Br)C#N)C
ethyl5(((5((4bromophenoxy)methyl)furan2yl)carbonyl)amino)4cyano3methylthiophene2carboxylate
ETHYL5((5((4BROMOPHENOXY)METHYL)FURAN2CARBONYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC21H17BrN2O5Sc132721(26)1812(2)16(1023)20(3018)2419(25)179815(2917)1128146413(22)5714h49H311H212H3(H2425)
MFCD04056546
ZINC000002792266
ZINC02792266
ZINC2792266
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