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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-propyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-propyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-propyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-propyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-propyl-2-(2-thienyl)cinchoninamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CCCN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C21H22N2O3S2/c1-2-10-23(15-9-12-28(25,26)14-15)21(24)17-13-19(20-8-5-11-27-20)22-18-7-4-3-6-16(17)18/h3-8,11,13,15H,2,9-10,12,14H2,1H3/t15-/m0/s1