methyl 3-[(2-phenylquinolin-4-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-phenylquinolin-4-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(2-phenylquinoline-4-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(2-phenylquinoline-4-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(2-phenylquinoline-4-carbonyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C26H18N2O3S MolecularWeight: 438.49772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H18N2O3S/c1-31-26(30)24-23(18-12-6-8-14-22(18)32-24)28-25(29)19-15-21(16-9-3-2-4-10-16)27-20-13-7-5-11-17(19)20/h2-15H,1H3,(H,28,29)