ethyl 4-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]-5-(phenylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]-5-(phenylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-5-(phenylcarbamoyl)thiophene-3-carboxylate CAS Name: 5-[anilino(oxo)methyl]-4-methyl-2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]-5-(phenylcarbamoyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-[[2-[(4-nitrophenyl)thio]acetyl]amino]-5-(phenylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H21N3O6S2 MolecularWeight: 499.55934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6S2/c1-3-32-23(29)19-14(2)20(21(28)24-15-7-5-4-6-8-15)34-22(19)25-18(27)13-33-17-11-9-16(10-12-17)26(30)31/h4-12H,3,13H2,1-2H3,(H,24,28)(H,25,27)