S-[2-oxidanylidene-2-[[6-oxidanylidene-6-(quinolin-5-ylamino)hexyl]amino]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[[6-oxidanylidene-6-(quinolin-5-ylamino)hexyl]amino]ethyl] ethanethioate Openeye Name: S-[2-oxo-2-[[6-oxo-6-(5-quinolylamino)hexyl]amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[[6-oxo-6-(5-quinolinylamino)hexyl]amino]ethyl] ester IUPAC Name: S-[2-oxo-2-[[6-oxo-6-(quinolin-5-ylamino)hexyl]amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[[6-keto-6-(5-quinolylamino)hexyl]amino]ethyl] ester Formula: C19H23N3O3S MolecularWeight: 373.46922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NCCCCCC(=O)NC1=CC=CC2=C1C=CC=N2

Isomeric SMILES

CC(=O)SCC(=O)NCCCCCC(=O)NC1=CC=CC2=C1C=CC=N2

InChI

InChI=1S/C19H23N3O3S/c1-14(23)26-13-19(25)21-11-4-2-3-10-18(24)22-17-9-5-8-16-15(17)7-6-12-20-16/h5-9,12H,2-4,10-11,13H2,1H3,(H,21,25)(H,22,24)