Vitas-M small molecule compound

methyl 3-{[(4-bromo-5-ethylthiophen-2-yl)carbonyl]amino}thiophene-2-carboxylate

Catalog ID
STK463913
SMILES COC(=O)c1sccc1NC(=O)c1cc(c(s1)CC)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 C13H12BrNO3S2 MW 374.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrNO3S2/c1-3-9-7(14)6-10(20-9)12(16)15-8-4-5-19-11(8)13(17)18-2/h4-6H,3H2,1-2H3,(H,15,16)
InChIKey
XDMHNCKZXIGGLH-UHFFFAOYSA-N
Synonyms

CCC1=C(C=C(S1)C(=O)NC2=C(SC=C2)C(=O)OC)Br
InChI=1SC13H12BrNO3S2c1397(14)610(209)12(16)158451911(8)13(17)182h46H3H212H3(H1516)
METHYL3(((4BROMO5ETHYL2THIENYL)CARBONYL)AMINO)2THIOPHENECARBOXYLATE
methyl3(((4bromo5ethylthiophen2yl)carbonyl)amino)thiophene2carboxylate
METHYL3((4BROMO5ETHYL2THIENYL)CARBONYLAMINO)THIOPHENE2CARBOXYLATE
METHYL3((4BROMO5ETHYLTHIOPHENE2CARBONYL)AMINO)THIOPHENE2CARBOXYLATE
MFCD06624972
ZINC000001055192
ZINC01055192
ZINC1055192

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.