5-[(E)-2-phenylethenyl]-2-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-[(E)-2-phenylethenyl]-2-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(4-phenylpiperazin-1-yl)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione CAS Name: 5-[(E)-2-phenylethenyl]-2-[(4-phenyl-1-piperazinyl)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-[(E)-2-phenylethenyl]-2-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[(4-phenylpiperazino)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione Formula: C21H23N5S MolecularWeight: 377.50582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N=C(N2)C=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5S/c27-21-22-20(12-11-18-7-3-1-4-8-18)23-26(21)17-24-13-15-25(16-14-24)19-9-5-2-6-10-19/h1-12H,13-17H2,(H,22,23,27)/b12-11+