propyl 4-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: propyl 4-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: propyl 4-[[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]ethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4,6,8-trimethyl-2-quinolyl)thio]acetyl]amino]benzoic acid propyl ester Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=C(C=C3C(=C2)C)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=C(C=C3C(=C2)C)C)C

InChI

InChI=1S/C24H26N2O3S/c1-5-10-29-24(28)18-6-8-19(9-7-18)25-21(27)14-30-22-13-16(3)20-12-15(2)11-17(4)23(20)26-22/h6-9,11-13H,5,10,14H2,1-4H3,(H,25,27)