methyl 2-[4-[[[2-(thiophen-2-ylcarbonylamino)phenyl]amino]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[[2-(thiophen-2-ylcarbonylamino)phenyl]amino]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[2-(thiophene-2-carbonylamino)anilino]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-[[oxo(thiophen-2-yl)methyl]amino]anilino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-(thiophene-2-carbonylamino)anilino]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-(2-thenoylamino)anilino]methyl]phenyl]benzoic acid methyl ester Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CNC3=CC=CC=C3NC(=O)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CNC3=CC=CC=C3NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H22N2O3S/c1-31-26(30)21-8-3-2-7-20(21)19-14-12-18(13-15-19)17-27-22-9-4-5-10-23(22)28-25(29)24-11-6-16-32-24/h2-16,27H,17H2,1H3,(H,28,29)