S-[3-phenyl-1-(phenylazanylcarbamoylamino)propyl] ethanethioate

Systemtic Name: S-[3-phenyl-1-(phenylazanylcarbamoylamino)propyl] ethanethioate Openeye Name: S-[1-(anilinocarbamoylamino)-3-phenyl-propyl] ethanethioate CAS Name: ethanethioic acid S-[1-[[oxo-(phenylhydrazo)methyl]amino]-3-phenylpropyl] ester IUPAC Name: S-[1-(anilinocarbamoylamino)-3-phenylpropyl] ethanethioate Traditional Name: ethanethioic acid S-[1-(anilinocarbamoylamino)-3-phenyl-propyl] ester Formula: C18H21N3O2S MolecularWeight: 343.44324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC1=CC=CC=C1)NC(=O)NNC2=CC=CC=C2

Isomeric SMILES

CC(=O)SC(CCC1=CC=CC=C1)NC(=O)NNC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O2S/c1-14(22)24-17(13-12-15-8-4-2-5-9-15)19-18(23)21-20-16-10-6-3-7-11-16/h2-11,17,20H,12-13H2,1H3,(H2,19,21,23)