ethyl 2-[2-(3-methylquinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-(3-methylquinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(3-methyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[(3-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-methylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(3-methyl-2-quinolyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C=C2C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C=C2C

InChI

InChI=1S/C21H20N2O3S/c1-3-26-21(25)16-9-5-7-11-18(16)22-19(24)13-27-20-14(2)12-15-8-4-6-10-17(15)23-20/h4-12H,3,13H2,1-2H3,(H,22,24)