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

Systemtic Name: methyl 4-[[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[4-(thiophene-2-carbonylamino)benzoyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(thiophene-2-carbonylamino)benzoyl]amino]methyl]benzoate Traditional Name: 4-[[[4-(2-thenoylamino)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18N2O4S/c1-27-21(26)16-6-4-14(5-7-16)13-22-19(24)15-8-10-17(11-9-15)23-20(25)18-3-2-12-28-18/h2-12H,13H2,1H3,(H,22,24)(H,23,25)