ethyl 3-[[ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]amino]methyl]benzofuran-2-carboxylate CAS Name: 3-[[ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[ethyl-[2-keto-2-(2-thenylamino)ethyl]amino]methyl]coumarilic acid ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(OC2=CC=CC=C21)C(=O)OCC)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CCN(CC1=C(OC2=CC=CC=C21)C(=O)OCC)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C21H24N2O4S/c1-3-23(14-19(24)22-12-15-8-7-11-28-15)13-17-16-9-5-6-10-18(16)27-20(17)21(25)26-4-2/h5-11H,3-4,12-14H2,1-2H3,(H,22,24)