N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)-2-propan-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)-2-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: N-isobutyl-2-isopropyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]thiazole-4-carboxamide CAS Name: N-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methylpropyl)-2-propan-2-yl-4-thiazolecarboxamide IUPAC Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)-2-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: N-isobutyl-2-isopropyl-N-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]thiazole-4-carboxamide Formula: C25H38N3O2S+ MolecularWeight: 444.65312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CSC(=N3)C(C)C

Isomeric SMILES

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CSC(=N3)C(C)C

InChI

InChI=1S/C25H37N3O2S/c1-18(2)14-28(25(29)22-17-31-24(26-22)19(3)4)15-20-10-12-27(13-11-20)16-21-8-6-7-9-23(21)30-5/h6-9,17-20H,10-16H2,1-5H3/p+1