methyl 2-chloranyl-5-(2-quinolin-8-ylsulfanylethanoylamino)benzoate

Systemtic Name: methyl 2-chloranyl-5-(2-quinolin-8-ylsulfanylethanoylamino)benzoate Openeye Name: methyl 2-chloro-5-[[2-(8-quinolylsulfanyl)acetyl]amino]benzoate CAS Name: 2-chloro-5-[[1-oxo-2-(8-quinolinylthio)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[(2-quinolin-8-ylsulfanylacetyl)amino]benzoate Traditional Name: 2-chloro-5-[[2-(8-quinolylthio)acetyl]amino]benzoic acid methyl ester Formula: C19H15ClN2O3S MolecularWeight: 386.852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O3S/c1-25-19(24)14-10-13(7-8-15(14)20)22-17(23)11-26-16-6-2-4-12-5-3-9-21-18(12)16/h2-10H,11H2,1H3,(H,22,23)