ethyl 4-(3-nitrophenyl)-2-[(2-phenethylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[(2-phenethylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[oxo-(2-phenethylphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C28H24N2O5S MolecularWeight: 500.56556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C28H24N2O5S/c1-2-35-28(32)25-24(21-12-8-13-22(17-21)30(33)34)18-36-27(25)29-26(31)23-14-7-6-11-20(23)16-15-19-9-4-3-5-10-19/h3-14,17-18H,2,15-16H2,1H3,(H,29,31)