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

Systemtic Name: propan-2-yl 4-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(4,8-dimethylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4,8-dimethyl-2-quinolyl)thio]acetyl]amino]benzoic acid isopropyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

InChI

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