butyl 4-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[[2-(2-thienyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]benzoate Traditional Name: 4-[[2-(2-thienyl)quinoline-4-carbonyl]amino]benzoic acid butyl ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C25H22N2O3S/c1-2-3-14-30-25(29)17-10-12-18(13-11-17)26-24(28)20-16-22(23-9-6-15-31-23)27-21-8-5-4-7-19(20)21/h4-13,15-16H,2-3,14H2,1H3,(H,26,28)