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

Systemtic Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(4-methoxyphenyl)piperazino]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5OS/c1-23-20(17-6-4-3-5-7-17)22-26(21(23)28)16-24-12-14-25(15-13-24)18-8-10-19(27-2)11-9-18/h3-11H,12-16H2,1-2H3