propyl 4-(4-tert-butylphenyl)-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propyl 4-(4-tert-butylphenyl)-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: propyl 4-(4-tert-butylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-tert-butylphenyl)-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 4-(4-tert-butylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-tert-butylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylic acid propyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H26N2O5S/c1-5-14-32-24(29)21-20(16-6-10-18(11-7-16)25(2,3)4)15-33-23(21)26-22(28)17-8-12-19(13-9-17)27(30)31/h6-13,15H,5,14H2,1-4H3,(H,26,28)