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

Systemtic Name: 4-cyclopropyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[(4-methylsulfonyl-1-piperazinyl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[(4-mesylpiperazino)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C16H22N6O2S2 MolecularWeight: 394.51488

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

InChI

InChI=1S/C16H22N6O2S2/c1-26(23,24)20-10-8-19(9-11-20)12-21-16(25)22(14-2-3-14)15(18-21)13-4-6-17-7-5-13/h4-7,14H,2-3,8-12H2,1H3