ethyl 2-[[5-[(4-bromanyl-2-chloranyl-phenoxy)methyl]furan-2-yl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-[(4-bromanyl-2-chloranyl-phenoxy)methyl]furan-2-yl]carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[5-[(4-bromo-2-chloro-phenoxy)methyl]furan-2-carbonyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[[5-[(4-bromo-2-chlorophenoxy)methyl]-2-furanyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[5-[(4-bromo-2-chlorophenoxy)methyl]furan-2-carbonyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[5-[(4-bromo-2-chloro-phenoxy)methyl]-2-furoyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H19BrClNO6S MolecularWeight: 540.81136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C22H19BrClNO6S/c1-4-29-22(28)18-11(2)19(12(3)26)32-21(18)25-20(27)17-8-6-14(31-17)10-30-16-7-5-13(23)9-15(16)24/h5-9H,4,10H2,1-3H3,(H,25,27)