ethyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-5-morpholin-4-ylcarbonyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-5-morpholin-4-ylcarbonyl-thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]-5-(morpholine-4-carbonyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-5-[4-morpholinyl(oxo)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]-5-(morpholine-4-carbonyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]-5-(morpholine-4-carbonyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O7S MolecularWeight: 461.48822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCOCC2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCOCC2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O7S/c1-4-31-21(27)16-13(3)17(20(26)23-7-9-30-10-8-23)32-19(16)22-18(25)14-6-5-12(2)15(11-14)24(28)29/h5-6,11H,4,7-10H2,1-3H3,(H,22,25)