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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-2-(3-pyridyl)cinchoninamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3S/c1-23(15-8-10-27(25,26)13-15)20(24)17-11-19(14-5-4-9-21-12-14)22-18-7-3-2-6-16(17)18/h2-7,9,11-12,15H,8,10,13H2,1H3