propyl 4-[(7-chloranyl-8-methyl-2-thiophen-2-yl-quinolin-4-yl)carbonylamino]benzoate

Systemtic Name: propyl 4-[(7-chloranyl-8-methyl-2-thiophen-2-yl-quinolin-4-yl)carbonylamino]benzoate Openeye Name: propyl 4-[[7-chloro-8-methyl-2-(2-thienyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[(7-chloro-8-methyl-2-thiophen-2-yl-4-quinolinyl)-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(7-chloro-8-methyl-2-thiophen-2-ylquinoline-4-carbonyl)amino]benzoate Traditional Name: 4-[[7-chloro-8-methyl-2-(2-thienyl)quinoline-4-carbonyl]amino]benzoic acid propyl ester Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC=CS4

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC=CS4

InChI

InChI=1S/C25H21ClN2O3S/c1-3-12-31-25(30)16-6-8-17(9-7-16)27-24(29)19-14-21(22-5-4-13-32-22)28-23-15(2)20(26)11-10-18(19)23/h4-11,13-14H,3,12H2,1-2H3,(H,27,29)