4-methyl-2-[(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-methyl-2-[(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[(4-morpholinosulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[[4-(4-morpholinylsulfonyl)-1-piperazin-1-iumyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[(4-morpholinosulfonylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C12H23N6O3S2+ MolecularWeight: 363.47942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN(C1=S)C[NH+]2CCN(CC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN1C=NN(C1=S)C[NH+]2CCN(CC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C12H22N6O3S2/c1-14-10-13-18(12(14)22)11-15-2-4-16(5-3-15)23(19,20)17-6-8-21-9-7-17/h10H,2-9,11H2,1H3/p+1