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

Systemtic Name: 1-(2,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(2,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)tetrazole-5-thione CAS Name: 1-(2,5-dimethylphenyl)-4-(1-piperidin-1-iumylmethyl)-5-tetrazolethione IUPAC Name: 1-(2,5-dimethylphenyl)-4-(piperidin-1-ium-1-ylmethyl)tetrazole-5-thione Traditional Name: 1-(2,5-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(=C(C=C1)C)N2C(=S)N(N=N2)C[NH+]3CCCCC3

Isomeric SMILES

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

InChI

InChI=1S/C15H21N5S/c1-12-6-7-13(2)14(10-12)20-15(21)19(16-17-20)11-18-8-4-3-5-9-18/h6-7,10H,3-5,8-9,11H2,1-2H3/p+1