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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-chloranyl-N-(2-methylpropyl)quinoline-4-carboxamide Openeye Name: 2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N-isobutyl-quinoline-4-carboxamide CAS Name: 2-chloro-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-(2-methylpropyl)-4-quinolinecarboxamide IUPAC Name: 2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methylpropyl)quinoline-4-carboxamide Traditional Name: 2-chloro-N-[(3S)-1,1-diketothiolan-3-yl]-N-isobutyl-cinchoninamide Formula: C18H21ClN2O3S MolecularWeight: 380.88894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O3S/c1-12(2)10-21(13-7-8-25(23,24)11-13)18(22)15-9-17(19)20-16-6-4-3-5-14(15)16/h3-6,9,12-13H,7-8,10-11H2,1-2H3/t13-/m0/s1