butyl 4-[2-(2-methylquinolin-8-yl)sulfanylethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(2-methylquinolin-8-yl)sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(2-methyl-8-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(2-methyl-8-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(2-methylquinolin-8-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2-methyl-8-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=C(C=C1)NC(=O)CSC2=CC=CC3=C2N=C(C=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC3=C2N=C(C=C3)C

InChI

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