2-[3-[(Z)-C-methyl-N-(2-quinolin-8-ylsulfanylethanoylamino)carbonimidoyl]phenoxy]ethanoate

Systemtic Name: 2-[3-[(Z)-C-methyl-N-(2-quinolin-8-ylsulfanylethanoylamino)carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[3-[(Z)-C-methyl-N-[[2-(8-quinolylsulfanyl)acetyl]amino]carbonimidoyl]phenoxy]acetate CAS Name: 2-[3-[(1Z)-1-[[1-oxo-2-(8-quinolinylthio)ethyl]hydrazinylidene]ethyl]phenoxy]acetate IUPAC Name: 2-[3-[(Z)-C-methyl-N-[(2-quinolin-8-ylsulfanylacetyl)amino]carbonimidoyl]phenoxy]acetate Traditional Name: 2-[3-[(Z)-C-methyl-N-[[2-(8-quinolylthio)acetyl]amino]carbonimidoyl]phenoxy]acetate Formula: C21H18N3O4S- MolecularWeight: 408.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=CC=CC2=C1N=CC=C2)C3=CC(=CC=C3)OCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)CSC1=CC=CC2=C1N=CC=C2)/C3=CC(=CC=C3)OCC(=O)[O-]

InChI

InChI=1S/C21H19N3O4S/c1-14(16-6-2-8-17(11-16)28-12-20(26)27)23-24-19(25)13-29-18-9-3-5-15-7-4-10-22-21(15)18/h2-11H,12-13H2,1H3,(H,24,25)(H,26,27)/p-1/b23-14-