1-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]piperidin-1-ium

Systemtic Name: 1-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]piperidin-1-ium Openeye Name: 1-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]piperidin-1-ium CAS Name: 1-[2-[(1-phenyl-5-tetrazolyl)thio]ethyl]piperidin-1-ium IUPAC Name: 1-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]piperidin-1-ium Traditional Name: 1-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]piperidin-1-ium Formula: C14H20N5S+ MolecularWeight: 290.4071

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C14H19N5S/c1-3-7-13(8-4-1)19-14(15-16-17-19)20-12-11-18-9-5-2-6-10-18/h1,3-4,7-8H,2,5-6,9-12H2/p+1