butyl 4-[[(1S)-2-(4-methylphenyl)-2-oxidanylidene-1-(thiophen-2-ylcarbonylamino)ethyl]amino]benzoate

Systemtic Name: butyl 4-[[(1S)-2-(4-methylphenyl)-2-oxidanylidene-1-(thiophen-2-ylcarbonylamino)ethyl]amino]benzoate Openeye Name: butyl 4-[[(1S)-2-oxo-2-(p-tolyl)-1-(thiophene-2-carbonylamino)ethyl]amino]benzoate CAS Name: 4-[[(1S)-2-(4-methylphenyl)-2-oxo-1-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(1S)-2-(4-methylphenyl)-2-oxo-1-(thiophene-2-carbonylamino)ethyl]amino]benzoate Traditional Name: 4-[[(1S)-2-keto-2-(p-tolyl)-1-(2-thenoylamino)ethyl]amino]benzoic acid butyl ester Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(C(=O)C2=CC=C(C=C2)C)NC(=O)C3=CC=CS3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N[C@H](C(=O)C2=CC=C(C=C2)C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C25H26N2O4S/c1-3-4-15-31-25(30)19-11-13-20(14-12-19)26-23(27-24(29)21-6-5-16-32-21)22(28)18-9-7-17(2)8-10-18/h5-14,16,23,26H,3-4,15H2,1-2H3,(H,27,29)/t23-/m0/s1