1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-methylpiperidin-1-ium-1-yl)ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-methylpiperidin-1-ium-1-yl)ethanone Openeye Name: 1-[2,5-dimethyl-1-(4-methylthiazol-2-yl)pyrrol-3-yl]-2-(4-methylpiperidin-1-ium-1-yl)ethanone CAS Name: 1-[2,5-dimethyl-1-(4-methyl-2-thiazolyl)-3-pyrrolyl]-2-(4-methyl-1-piperidin-1-iumyl)ethanone IUPAC Name: 1-[2,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-methylpiperidin-1-ium-1-yl)ethanone Traditional Name: 1-[2,5-dimethyl-1-(4-methylthiazol-2-yl)pyrrol-3-yl]-2-(4-methylpiperidin-1-ium-1-yl)ethanone Formula: C18H26N3OS+ MolecularWeight: 332.48354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)C2=C(N(C(=C2)C)C3=NC(=CS3)C)C

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)C2=C(N(C(=C2)C)C3=NC(=CS3)C)C

InChI

InChI=1S/C18H25N3OS/c1-12-5-7-20(8-6-12)10-17(22)16-9-14(3)21(15(16)4)18-19-13(2)11-23-18/h9,11-12H,5-8,10H2,1-4H3/p+1