ethyl 2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-4-methyl-5-[oxo-(1-phenylethylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H22N4O8S MolecularWeight: 526.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O8S/c1-4-36-24(31)19-13(2)20(22(30)25-14(3)15-8-6-5-7-9-15)37-23(19)26-21(29)16-10-17(27(32)33)12-18(11-16)28(34)35/h5-12,14H,4H2,1-3H3,(H,25,30)(H,26,29)