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

Systemtic Name: 4-cyclopropyl-5-methyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-methyl-2-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-methyl-2-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-methyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-methyl-2-[(4-tosylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C18H25N5O2S2 MolecularWeight: 407.5534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=S)N(C(=N3)C)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=S)N(C(=N3)C)C4CC4

InChI

InChI=1S/C18H25N5O2S2/c1-14-3-7-17(8-4-14)27(24,25)21-11-9-20(10-12-21)13-22-18(26)23(15(2)19-22)16-5-6-16/h3-4,7-8,16H,5-6,9-13H2,1-2H3