butyl 3-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: butyl 3-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: butyl 3-[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]benzoic acid butyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O3S/c1-3-4-12-28-23(27)17-8-7-9-18(14-17)24-21(26)15-29-22-13-16(2)19-10-5-6-11-20(19)25-22/h5-11,13-14H,3-4,12,15H2,1-2H3,(H,24,26)