5-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[[4-(2-chlorophenyl)piperazino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C19H19ClN5S- MolecularWeight: 384.90566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NN=C(N2C3=CC=CC=C3)[S-])C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1CC2=NN=C(N2C3=CC=CC=C3)[S-])C4=CC=CC=C4Cl

InChI

InChI=1S/C19H20ClN5S/c20-16-8-4-5-9-17(16)24-12-10-23(11-13-24)14-18-21-22-19(26)25(18)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,22,26)/p-1