ethyl 3-[[(2-methyl-8-oxidanyl-quinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate

Systemtic Name: ethyl 3-[[(2-methyl-8-oxidanyl-quinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate Openeye Name: ethyl 3-[[(8-hydroxy-2-methyl-7-quinolyl)-(2-thienyl)methyl]amino]benzoate CAS Name: 3-[[(8-hydroxy-2-methyl-7-quinolinyl)-thiophen-2-ylmethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(8-hydroxy-2-methylquinolin-7-yl)-thiophen-2-ylmethyl]amino]benzoate Traditional Name: 3-[[(8-hydroxy-2-methyl-7-quinolyl)-(2-thienyl)methyl]amino]benzoic acid ethyl ester Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC(=N3)C)C=C2)O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC(=N3)C)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C24H22N2O3S/c1-3-29-24(28)17-6-4-7-18(14-17)26-22(20-8-5-13-30-20)19-12-11-16-10-9-15(2)25-21(16)23(19)27/h4-14,22,26-27H,3H2,1-2H3