ethyl 3-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[3-(4-chlorophenyl)sulfanylpropanoylamino]benzofuran-2-carboxylate CAS Name: 3-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1-benzofuran-2-carboxylate Traditional Name: 3-[3-[(4-chlorophenyl)thio]propanoylamino]coumarilic acid ethyl ester Formula: C20H18ClNO4S MolecularWeight: 403.87922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO4S/c1-2-25-20(24)19-18(15-5-3-4-6-16(15)26-19)22-17(23)11-12-27-14-9-7-13(21)8-10-14/h3-10H,2,11-12H2,1H3,(H,22,23)