ethyl 5-methyl-4-(4-nitrophenyl)-2-(propanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(propanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(propanoylamino)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-nitrophenyl)-2-(1-oxopropylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(propanoylamino)thiophene-3-carboxylate Traditional Name: 5-methyl-4-(4-nitrophenyl)-2-propionamido-thiophene-3-carboxylic acid ethyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C17H18N2O5S/c1-4-13(20)18-16-15(17(21)24-5-2)14(10(3)25-16)11-6-8-12(9-7-11)19(22)23/h6-9H,4-5H2,1-3H3,(H,18,20)