propyl 4-(4-butan-2-ylphenyl)-5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propyl 4-(4-butan-2-ylphenyl)-5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: propyl 5-methyl-2-[(4-nitrobenzoyl)amino]-4-(4-sec-butylphenyl)thiophene-3-carboxylate CAS Name: 4-(4-butan-2-ylphenyl)-5-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 4-(4-butan-2-ylphenyl)-5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(4-nitrobenzoyl)amino]-4-(4-sec-butylphenyl)thiophene-3-carboxylic acid propyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O5S/c1-5-15-33-26(30)23-22(19-9-7-18(8-10-19)16(3)6-2)17(4)34-25(23)27-24(29)20-11-13-21(14-12-20)28(31)32/h7-14,16H,5-6,15H2,1-4H3,(H,27,29)