methyl 4-(4-ethoxyphenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[(1-oxo-2-phenoxyethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(2-phenoxyacetyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H21NO5S/c1-3-27-17-11-9-15(10-12-17)18-14-29-21(20(18)22(25)26-2)23-19(24)13-28-16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3,(H,23,24)