ethyl 4-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoylamino]benzoate CAS Name: 4-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[(4,8-dimethyl-2-quinolyl)thio]propanoylamino]benzoic acid ethyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C23H24N2O3S/c1-5-28-23(27)17-9-11-18(12-10-17)24-22(26)16(4)29-20-13-15(3)19-8-6-7-14(2)21(19)25-20/h6-13,16H,5H2,1-4H3,(H,24,26)