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

Systemtic Name: ethyl 2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-5-(propan-2-ylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(3,5-dinitrobenzoyl)amino]-5-(isopropylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-4-methyl-5-[oxo-(propan-2-ylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,5-dinitrobenzoyl)amino]-4-methyl-5-(propan-2-ylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-5-(isopropylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H20N4O8S MolecularWeight: 464.4491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O8S/c1-5-31-19(26)14-10(4)15(17(25)20-9(2)3)32-18(14)21-16(24)11-6-12(22(27)28)8-13(7-11)23(29)30/h6-9H,5H2,1-4H3,(H,20,25)(H,21,24)