2-[[[(E)-quinolin-2-ylmethylideneamino]carbamothioylamino]methoxy]ethyl ethanoate

Systemtic Name: 2-[[[(E)-quinolin-2-ylmethylideneamino]carbamothioylamino]methoxy]ethyl ethanoate Openeye Name: 2-[[[(E)-2-quinolylmethyleneamino]carbamothioylamino]methoxy]ethyl acetate CAS Name: acetic acid 2-[[[[(2E)-2-(2-quinolinylmethylidene)hydrazinyl]-sulfanylidenemethyl]amino]methoxy]ethyl ester IUPAC Name: 2-[[[(E)-quinolin-2-ylmethylideneamino]carbamothioylamino]methoxy]ethyl acetate Traditional Name: acetic acid 2-[[[(E)-2-quinolylmethyleneamino]thiocarbamoylamino]methoxy]ethyl ester Formula: C16H18N4O3S MolecularWeight: 346.40412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOCNC(=S)NN=CC1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CC(=O)OCCOCNC(=S)N/N=C/C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C16H18N4O3S/c1-12(21)23-9-8-22-11-17-16(24)20-18-10-14-7-6-13-4-2-3-5-15(13)19-14/h2-7,10H,8-9,11H2,1H3,(H2,17,20,24)/b18-10+