N-(2-methoxyethyl)-1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methoxyethyl)-1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-methoxyethyl)-1-[1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]triazole-4-carboxamide CAS Name: N-(2-methoxyethyl)-1-[1-[(5-methyl-2-thiophenyl)methyl]-4-piperidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: N-(2-methoxyethyl)-1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Traditional Name: N-(2-methoxyethyl)-1-[1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Formula: C17H26N5O2S+ MolecularWeight: 364.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+]2CCC(CC2)N3C=C(N=N3)C(=O)NCCOC

Isomeric SMILES

CC1=CC=C(S1)C[NH+]2CCC(CC2)N3C=C(N=N3)C(=O)NCCOC

InChI

InChI=1S/C17H25N5O2S/c1-13-3-4-15(25-13)11-21-8-5-14(6-9-21)22-12-16(19-20-22)17(23)18-7-10-24-2/h3-4,12,14H,5-11H2,1-2H3,(H,18,23)/p+1