butyl 3-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: butyl 3-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: butyl 3-[[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-(4,8-dimethylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(4,8-dimethyl-2-quinolyl)thio]acetyl]amino]benzoic acid butyl ester Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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