5-phenyl-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-phenyl-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione CAS Name: 5-phenyl-2-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-phenyl-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[4-[(E)-cinnamyl]piperazino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Formula: C22H25N5S MolecularWeight: 391.5324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)CN3C(=S)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)CN3C(=S)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5S/c28-22-23-21(20-11-5-2-6-12-20)24-27(22)18-26-16-14-25(15-17-26)13-7-10-19-8-3-1-4-9-19/h1-12H,13-18H2,(H,23,24,28)/b10-7+