N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[(4,5-dimethylthiazol-2-yl)methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[(4,5-dimethyl-2-thiazolyl)methyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[(4,5-dimethylthiazol-2-yl)methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C26H32N3O2S+ MolecularWeight: 450.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=N1)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4)C

InChI

InChI=1S/C26H31N3O2S/c1-19-20(2)32-25(28-19)18-27-26(30)22-8-10-23(11-9-22)31-24-13-16-29(17-14-24)15-12-21-6-4-3-5-7-21/h3-11,24H,12-18H2,1-2H3,(H,27,30)/p+1