[2-[[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C19H22N3O2S+ MolecularWeight: 356.46188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H21N3O2S/c1-22(2)12-15-8-4-3-7-14(15)11-20-18(23)13-25-19-21-16-9-5-6-10-17(16)24-19/h3-10H,11-13H2,1-2H3,(H,20,23)/p+1