methyl 3-[(5-bromanylfuran-2-yl)carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(5-bromanylfuran-2-yl)carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(5-bromo-2-furanyl)-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(5-bromo-2-furoyl)amino]-3-(2-thienyl)propionic acid methyl ester Formula: C13H12BrNO4S MolecularWeight: 358.20768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C13H12BrNO4S/c1-18-12(16)7-8(10-3-2-6-20-10)15-13(17)9-4-5-11(14)19-9/h2-6,8H,7H2,1H3,(H,15,17)