N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-methylacetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-methyl-acetamide Formula: C18H26N3OS+ MolecularWeight: 332.48354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)N(C)CC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC(=O)N(C)CC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H25N3OS/c1-13-8-14(2)10-21(9-13)12-18(22)20(3)11-17-19-15-6-4-5-7-16(15)23-17/h4-7,13-14H,8-12H2,1-3H3/p+1/t13-,14-/m1/s1