[2-[2-(4-bromophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-[2-(4-bromophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-[2-(4-bromobenzoyl)hydrazino]-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-[[(4-bromophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromobenzoyl)hydrazinyl]-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-[N'-(4-bromobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C18H17BrN2O4S MolecularWeight: 437.30758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H17BrN2O4S/c19-14-8-6-13(7-9-14)18(24)21-20-16(22)12-25-17(23)10-11-26-15-4-2-1-3-5-15/h1-9H,10-12H2,(H,20,22)(H,21,24)