4-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[(4-methylsulfonyl-1-piperazinyl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[(4-mesylpiperazino)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C15H22N6O2S2 MolecularWeight: 382.50418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C)C3=CC=NC=C3

InChI

InChI=1S/C15H22N6O2S2/c1-3-20-14(13-4-6-16-7-5-13)17-21(15(20)24)12-18-8-10-19(11-9-18)25(2,22)23/h4-7H,3,8-12H2,1-2H3