2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-[4-(1-piperidyl)phenyl]acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]-N-[4-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(4-piperidinophenyl)acetamide Formula: C25H31N4OS+ MolecularWeight: 435.60484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H30N4OS/c30-24(26-20-8-10-21(11-9-20)29-14-4-1-5-15-29)18-28-16-12-19(13-17-28)25-27-22-6-2-3-7-23(22)31-25/h2-3,6-11,19H,1,4-5,12-18H2,(H,26,30)/p+1