methyl-[[1-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]methyl]azanium

Systemtic Name: methyl-[[1-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]methyl]azanium Openeye Name: methyl-[[1-[1-(3-thienylmethyl)piperidin-1-ium-4-yl]triazol-4-yl]methyl]ammonium CAS Name: methyl-[[1-[1-(3-thiophenylmethyl)-4-piperidin-1-iumyl]-4-triazolyl]methyl]ammonium IUPAC Name: methyl-[[1-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]triazol-4-yl]methyl]azanium Traditional Name: methyl-[[1-[1-(3-thenyl)piperidin-1-ium-4-yl]triazol-4-yl]methyl]ammonium Formula: C14H23N5S+2 MolecularWeight: 293.43092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1=CN(N=N1)C2CC[NH+](CC2)CC3=CSC=C3

Isomeric SMILES

C[NH2+]CC1=CN(N=N1)C2CC[NH+](CC2)CC3=CSC=C3

InChI

InChI=1S/C14H21N5S/c1-15-8-13-10-19(17-16-13)14-2-5-18(6-3-14)9-12-4-7-20-11-12/h4,7,10-11,14-15H,2-3,5-6,8-9H2,1H3/p+2