[2-(4-butylphenyl)-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: [2-(4-butylphenyl)-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: [2-(4-butylphenyl)-2-oxo-ethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate CAS Name: 5-[[2-furanyl(oxo)methyl]amino]-2-thiophenecarboxylic acid [2-(4-butylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-butylphenyl)-2-oxoethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate Traditional Name: 5-(2-furoylamino)thiophene-2-carboxylic acid [2-(4-butylphenyl)-2-keto-ethyl] ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(S2)NC(=O)C3=CC=CO3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(S2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H21NO5S/c1-2-3-5-15-7-9-16(10-8-15)17(24)14-28-22(26)19-11-12-20(29-19)23-21(25)18-6-4-13-27-18/h4,6-13H,2-3,5,14H2,1H3,(H,23,25)