N-[4-oxidanyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]hexadecanamide

Systemtic Name: N-[4-oxidanyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]hexadecanamide Openeye Name: N-[4-hydroxy-3-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]hexadecanamide CAS Name: N-[4-hydroxy-3-[[(1-phenyl-5-tetrazolyl)thio]methyl]phenyl]hexadecanamide IUPAC Name: N-[4-hydroxy-3-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]hexadecanamide Traditional Name: N-[4-hydroxy-3-[[(1-phenyltetrazol-5-yl)thio]methyl]phenyl]palmitamide Formula: C30H43N5O2S MolecularWeight: 537.75972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)O)CSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)O)CSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C30H43N5O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-29(37)31-26-21-22-28(36)25(23-26)24-38-30-32-33-34-35(30)27-18-15-14-16-19-27/h14-16,18-19,21-23,36H,2-13,17,20,24H2,1H3,(H,31,37)