1-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C14H19N6OS+ MolecularWeight: 319.40526

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CN2C(=S)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CN2C(=S)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C14H18N6OS/c15-13(21)11-6-8-18(9-7-11)10-19-14(22)20(17-16-19)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,15,21)/p+1