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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-(p-tolyl)cinchoninamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCS(=O)(=O)C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCS(=O)(=O)C4

InChI

InChI=1S/C21H20N2O3S/c1-14-6-8-15(9-7-14)20-12-18(17-4-2-3-5-19(17)23-20)21(24)22-16-10-11-27(25,26)13-16/h2-9,12,16H,10-11,13H2,1H3,(H,22,24)