6-[(E)-N-oxidanyl-C-[(1-phenylimidazol-2-yl)sulfanylmethyl]carbonimidoyl]-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 6-[(E)-N-oxidanyl-C-[(1-phenylimidazol-2-yl)sulfanylmethyl]carbonimidoyl]-3,4-dihydro-1H-quinolin-2-one Openeye Name: 6-[(E)-N-hydroxy-C-[(1-phenylimidazol-2-yl)sulfanylmethyl]carbonimidoyl]-3,4-dihydro-1H-quinolin-2-one CAS Name: 6-[(1E)-1-hydroxyimino-2-[(1-phenyl-2-imidazolyl)thio]ethyl]-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 6-[(E)-N-hydroxy-C-[(1-phenylimidazol-2-yl)sulfanylmethyl]carbonimidoyl]-3,4-dihydro-1H-quinolin-2-one Traditional Name: 6-[2-[(1-phenylimidazol-2-yl)thio]acetohydroximoyl]-3,4-dihydrocarbostyril Formula: C20H18N4O2S MolecularWeight: 378.44752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)C(=NO)CSC3=NC=CN3C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)/C(=N\O)/CSC3=NC=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c25-19-9-7-14-12-15(6-8-17(14)22-19)18(23-26)13-27-20-21-10-11-24(20)16-4-2-1-3-5-16/h1-6,8,10-12,26H,7,9,13H2,(H,22,25)/b23-18-