propyl 2-[(5-bromanylfuran-2-yl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: propyl 2-[(5-bromanylfuran-2-yl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: propyl 2-[(5-bromofuran-2-carbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[(5-bromofuran-2-carbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(5-bromo-2-furoyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid propyl ester Formula: C21H20BrNO5S MolecularWeight: 478.3562

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OCC)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OCC)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C21H20BrNO5S/c1-3-11-27-21(25)18-15(13-5-7-14(8-6-13)26-4-2)12-29-20(18)23-19(24)16-9-10-17(22)28-16/h5-10,12H,3-4,11H2,1-2H3,(H,23,24)