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

Systemtic Name: propan-2-yl 5-(diethylcarbamoyl)-2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 5-(diethylcarbamoyl)-2-[(3,5-dinitrobenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-(diethylcarbamoyl)-2-[(3,5-dinitrobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(3,5-dinitrobenzoyl)amino]-4-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C21H24N4O8S MolecularWeight: 492.50226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC(C)C)C

InChI

InChI=1S/C21H24N4O8S/c1-6-23(7-2)20(27)17-12(5)16(21(28)33-11(3)4)19(34-17)22-18(26)13-8-14(24(29)30)10-15(9-13)25(31)32/h8-11H,6-7H2,1-5H3,(H,22,26)