2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(3-bromophenyl)sulfonylpiperazino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C19H20BrN5O2S2 MolecularWeight: 494.4284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N(C=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CN2C(=S)N(C=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C19H20BrN5O2S2/c20-16-5-4-8-18(13-16)29(26,27)23-11-9-22(10-12-23)15-25-19(28)24(14-21-25)17-6-2-1-3-7-17/h1-8,13-14H,9-12,15H2