Vitas-M small molecule compound
ethyl 5-(azepan-1-ylcarbonyl)-2-{[(4-bromophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK375647
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)Br)sc(c1C)C(=O)N1CCCCCC1
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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 C22H25BrN2O4S MW 493.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN2O4S/c1-3-29-22(28)17-14(2)18(21(27)25-12-6-4-5-7-13-25)30-20(17)24-19(26)15-8-10-16(23)11-9-15/h8-11H,3-7,12-13H2,1-2H3,(H,24,26)InChIKey
LWFDNKILMHTYDH-UHFFFAOYSA-NSynonyms
5(AZEPANE1CARBONYL)2(4BROMOBENZOYLAMINO)4METHYLTHIOPHENE3CARBOXYLIC
CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCCC2)NC(=O)C3=CC=C(C=C3)Br
ETHYL5(AZAPERHYDROEPINYLCARBONYL)2((4BROMOPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
ethyl5(azepan1ylcarbonyl)2(((4bromophenyl)carbonyl)amino)4methylthiophene3carboxylate
ETHYL5(AZEPANE1CARBONYL)2((4BROMOBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H25BrN2O4Sc132922(28)1714(2)18(21(27)251264571325)3020(17)2419(26)1581016(23)11915h811H371213H212H3(H2426)
MFCD01191849
ZINC000000629314
ZINC00629314
ZINC629314
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