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

Systemtic Name: ethyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-5-(propylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]-5-(propylcarbamoyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-5-[oxo(propylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]-5-(propylcarbamoyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]-5-(propylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C(=O)OCC)C

Isomeric SMILES

CCCNC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C(=O)OCC)C

InChI

InChI=1S/C20H23N3O6S/c1-5-9-21-18(25)16-12(4)15(20(26)29-6-2)19(30-16)22-17(24)13-8-7-11(3)14(10-13)23(27)28/h7-8,10H,5-6,9H2,1-4H3,(H,21,25)(H,22,24)