[2-[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexanecarbonyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexanecarbonyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[1-(1,3-benzothiazol-2-ylmethyl)cyclohexanecarbonyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C25H32N3OS+ MolecularWeight: 422.60608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2(CCCCC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)C2(CCCCC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H31N3OS/c1-28(2)18-20-11-5-4-10-19(20)17-26-24(29)25(14-8-3-9-15-25)16-23-27-21-12-6-7-13-22(21)30-23/h4-7,10-13H,3,8-9,14-18H2,1-2H3,(H,26,29)/p+1