1-(2,5-dimethylphenyl)-4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(2,5-dimethylphenyl)-4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(2,5-dimethylphenyl)-4-[(4-methylpiperidin-1-ium-1-yl)methyl]tetrazole-5-thione CAS Name: 1-(2,5-dimethylphenyl)-4-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-tetrazolethione IUPAC Name: 1-(2,5-dimethylphenyl)-4-[(4-methylpiperidin-1-ium-1-yl)methyl]tetrazole-5-thione Traditional Name: 1-(2,5-dimethylphenyl)-4-[(4-methylpiperidin-1-ium-1-yl)methyl]tetrazole-5-thione Formula: C16H24N5S+ MolecularWeight: 318.46026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)N(N=N2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)N(N=N2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C16H23N5S/c1-12-6-8-19(9-7-12)11-20-16(22)21(18-17-20)15-10-13(2)4-5-14(15)3/h4-5,10,12H,6-9,11H2,1-3H3/p+1