N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-chlorophenyl)-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-chlorophenyl)-N-methyl-quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methyl-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylquinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-cinchoninamide Formula: C21H19ClN2O3S MolecularWeight: 414.90516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-24(16-10-11-28(26,27)13-16)21(25)18-12-20(14-6-8-15(22)9-7-14)23-19-5-3-2-4-17(18)19/h2-9,12,16H,10-11,13H2,1H3/t16-/m0/s1