4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)butyramide Formula: C18H26N3OS+ MolecularWeight: 332.48354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H25N3OS/c1-20-12-10-14(11-13-20)21(2)18(22)9-5-8-17-19-15-6-3-4-7-16(15)23-17/h3-4,6-7,14H,5,8-13H2,1-2H3/p+1