6-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2H-1,2,4-triazine-3-thione

Systemtic Name: 6-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2H-1,2,4-triazine-3-thione Openeye Name: 6-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2H-1,2,4-triazine-3-thione CAS Name: 6-methyl-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2H-1,2,4-triazine-3-thione IUPAC Name: 6-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2H-1,2,4-triazine-3-thione Traditional Name: 6-methyl-5-(4-pyridin-1-ium-2-ylpiperazino)-2H-1,2,4-triazine-3-thione Formula: C13H17N6S+ MolecularWeight: 289.37928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N=C1N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=NNC(=S)N=C1N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C13H16N6S/c1-10-12(15-13(20)17-16-10)19-8-6-18(7-9-19)11-4-2-3-5-14-11/h2-5H,6-9H2,1H3,(H,15,17,20)/p+1