ethyl 5-ethyl-2-[(3-nitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(3-nitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[(3-nitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(3-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(3-nitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O5S/c1-3-17-18(14-9-6-5-7-10-14)19(22(26)29-4-2)21(30-17)23-20(25)15-11-8-12-16(13-15)24(27)28/h5-13H,3-4H2,1-2H3,(H,23,25)