N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide Openeye Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,4-dimethyl-thiazole-5-carboxamide CAS Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N,4-dimethyl-5-thiazolecarboxamide IUPAC Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide Traditional Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,4-dimethyl-thiazole-5-carboxamide Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(SC=N1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=CC=C3OC

InChI

InChI=1S/C21H29N3O2S/c1-16-20(27-15-22-16)21(25)23(2)14-17-8-11-24(12-9-17)13-10-18-6-4-5-7-19(18)26-3/h4-7,15,17H,8-14H2,1-3H3/p+1