1-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)tetrazole-5-thione CAS Name: 1-(3,5-dimethylphenyl)-4-(1-piperidin-1-iumylmethyl)-5-tetrazolethione IUPAC Name: 1-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)tetrazole-5-thione Traditional Name: 1-(3,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)tetrazole-5-thione Formula: C15H22N5S+ MolecularWeight: 304.43368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=S)N(N=N2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=S)N(N=N2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C15H21N5S/c1-12-8-13(2)10-14(9-12)20-15(21)19(16-17-20)11-18-6-4-3-5-7-18/h8-10H,3-7,11H2,1-2H3/p+1