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

Systemtic Name: 5-[(2-chloranylphenoxy)methyl]-4-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-[(4-methylsulfonyl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-[(2-chlorophenoxy)methyl]-4-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-[(2-chlorophenoxy)methyl]-2-[(4-mesylpiperazino)methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C16H22ClN5O3S2 MolecularWeight: 431.96058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C)COC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C)COC3=CC=CC=C3Cl

InChI

InChI=1S/C16H22ClN5O3S2/c1-19-15(11-25-14-6-4-3-5-13(14)17)18-22(16(19)26)12-20-7-9-21(10-8-20)27(2,23)24/h3-6H,7-12H2,1-2H3