2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-ium-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-ium-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-ium-1-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazin-1-iumyl]-N-[[(2R)-2-oxolanyl]methyl]acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-ium-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-ium-1-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C19H27N4O2S+ MolecularWeight: 375.50828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C[NH+]2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)C[NH+]2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H26N4O2S/c24-18(20-12-15-4-3-11-25-15)13-22-7-9-23(10-8-22)14-19-21-16-5-1-2-6-17(16)26-19/h1-2,5-6,15H,3-4,7-14H2,(H,20,24)/p+1/t15-/m1/s1