N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-(4-methylthiazol-5-yl)propyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide CAS Name: N-[3-(4-methyl-5-thiazolyl)propyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Traditional Name: N-[3-(4-methylthiazol-5-yl)propyl]-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Formula: C17H27N6OS+ MolecularWeight: 363.50088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)CCCNC(=O)C2=CN(N=N2)CC[NH+]3CCCCC3

Isomeric SMILES

CC1=C(SC=N1)CCCNC(=O)C2=CN(N=N2)CC[NH+]3CCCCC3

InChI

InChI=1S/C17H26N6OS/c1-14-16(25-13-19-14)6-5-7-18-17(24)15-12-23(21-20-15)11-10-22-8-3-2-4-9-22/h12-13H,2-11H2,1H3,(H,18,24)/p+1