4-[(4R)-2-azanyl-3-cyano-4-(4-methylsulfanylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide

Systemtic Name: 4-[(4R)-2-azanyl-3-cyano-4-(4-methylsulfanylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide Openeye Name: 4-[(4R)-2-amino-3-cyano-4-(4-methylsulfanylphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide CAS Name: 4-[(4R)-2-amino-3-cyano-4-[4-(methylthio)phenyl]-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide IUPAC Name: 4-[(4R)-2-amino-3-cyano-4-(4-methylsulfanylphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide Traditional Name: 4-[(4R)-2-amino-3-cyano-5-keto-4-[4-(methylthio)phenyl]-4,6,7,8-tetrahydroquinolin-1-yl]benzenesulfonamide Formula: C23H22N4O3S2 MolecularWeight: 466.57578

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)S(=O)(=O)N)N)C#N

Isomeric SMILES

CSC1=CC=C(C=C1)[C@@H]2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)S(=O)(=O)N)N)C#N

InChI

InChI=1S/C23H22N4O3S2/c1-31-16-9-5-14(6-10-16)21-18(13-24)23(25)27(19-3-2-4-20(28)22(19)21)15-7-11-17(12-8-15)32(26,29)30/h5-12,21H,2-4,25H2,1H3,(H2,26,29,30)/t21-/m1/s1