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

Systemtic Name: methyl 2-[(3,5-dinitrophenyl)carbonylamino]-4-methyl-5-(propan-2-ylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C18H18N4O8S MolecularWeight: 450.42252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)NC(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)NC(C)C

InChI

InChI=1S/C18H18N4O8S/c1-8(2)19-16(24)14-9(3)13(18(25)30-4)17(31-14)20-15(23)10-5-11(21(26)27)7-12(6-10)22(28)29/h5-8H,1-4H3,(H,19,24)(H,20,23)