ethyl 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethylphenyl)-2-[(2-nitrophenyl)sulfonylamino]thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O6S2/c1-4-29-21(24)19-16(15-10-9-13(2)14(3)11-15)12-30-20(19)22-31(27,28)18-8-6-5-7-17(18)23(25)26/h5-12,22H,4H2,1-3H3