1,3-benzothiazol-2-ylmethyl-[1-[4-[(2-fluorophenyl)carbonylamino]phenyl]piperidin-4-yl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[1-[4-[(2-fluorophenyl)carbonylamino]phenyl]piperidin-4-yl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[1-[4-[(2-fluorobenzoyl)amino]phenyl]-4-piperidyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[1-[4-[[(2-fluorophenyl)-oxomethyl]amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[1-[4-[(2-fluorobenzoyl)amino]phenyl]piperidin-4-yl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[1-[4-[(2-fluorobenzoyl)amino]phenyl]-4-piperidyl]ammonium Formula: C26H26FN4OS+ MolecularWeight: 461.574243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CC2=NC3=CC=CC=C3S2)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCC1[NH2+]CC2=NC3=CC=CC=C3S2)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H25FN4OS/c27-22-6-2-1-5-21(22)26(32)29-19-9-11-20(12-10-19)31-15-13-18(14-16-31)28-17-25-30-23-7-3-4-8-24(23)33-25/h1-12,18,28H,13-17H2,(H,29,32)/p+1