2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine

Systemtic Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine Openeye Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-[(4-phenylthiazol-2-yl)methyl]ethanamine CAS Name: 2-(4-methoxyphenyl)-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-[(4-phenyl-2-thiazolyl)methyl]ethanamine IUPAC Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamine Traditional Name: 2-(4-methoxyphenyl)ethyl-[(1-methylpiperidin-1-ium-4-yl)methyl]-[(4-phenylthiazol-2-yl)methyl]amine Formula: C26H34N3OS+ MolecularWeight: 436.63266

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)CC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)CC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N3OS/c1-28-15-12-22(13-16-28)18-29(17-14-21-8-10-24(30-2)11-9-21)19-26-27-25(20-31-26)23-6-4-3-5-7-23/h3-11,20,22H,12-19H2,1-2H3/p+1