methyl 3-ethoxy-5-[(2-ethoxyphenyl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-ethoxy-5-[(2-ethoxyphenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-ethoxy-5-[(2-ethoxybenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-ethoxy-5-[[(2-ethoxyphenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-ethoxy-5-[(2-ethoxybenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-ethoxy-5-[(2-ethoxybenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)SC(=C3OCC)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)SC(=C3OCC)C(=O)OC

InChI

InChI=1S/C21H21NO5S/c1-4-26-16-9-7-6-8-14(16)20(23)22-13-10-11-17-15(12-13)18(27-5-2)19(28-17)21(24)25-3/h6-12H,4-5H2,1-3H3,(H,22,23)