ethyl 2-[[5-(ethoxymethyl)furan-2-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-(ethoxymethyl)furan-2-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[5-(ethoxymethyl)furan-2-carbonyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[5-(ethoxymethyl)-2-furanyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(ethoxymethyl)furan-2-carbonyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[5-(ethoxymethyl)-2-furoyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(O1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOCC1=CC=C(O1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H21NO5S/c1-3-25-12-15-10-11-17(27-15)19(23)22-20-18(21(24)26-4-2)16(13-28-20)14-8-6-5-7-9-14/h5-11,13H,3-4,12H2,1-2H3,(H,22,23)