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

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

CCCCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCCC)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCCC)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O5S/c1-3-5-6-17-7-9-18(10-8-17)21-16-33-24(22(21)25(29)32-15-4-2)26-23(28)19-11-13-20(14-12-19)27(30)31/h7-14,16H,3-6,15H2,1-2H3,(H,26,28)