1-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-N,N-diethyl-6-oxidanylidene-pyridine-3-sulfonamide

Systemtic Name: 1-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-N,N-diethyl-6-oxidanylidene-pyridine-3-sulfonamide Openeye Name: 1-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl]-N,N-diethyl-6-oxo-pyridine-3-sulfonamide CAS Name: 1-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl]-N,N-diethyl-6-oxo-3-pyridinesulfonamide IUPAC Name: 1-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide Traditional Name: 1-[[2-chloro-7-(methylthio)-3-quinolyl]methyl]-N,N-diethyl-6-keto-pyridine-3-sulfonamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=O)C=C1)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=O)C=C1)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-4-24(5-2)29(26,27)17-8-9-19(25)23(13-17)12-15-10-14-6-7-16(28-3)11-18(14)22-20(15)21/h6-11,13H,4-5,12H2,1-3H3