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

Systemtic Name: 2-[(4-phenethylpiperidin-1-yl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(4-phenethyl-1-piperidyl)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione CAS Name: 2-[(4-phenethyl-1-piperidinyl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-phenethylpiperidin-1-yl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[(4-phenethylpiperidino)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione Formula: C24H28N4S MolecularWeight: 404.57092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC2=CC=CC=C2)CN3C(=S)N=C(N3)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCC2=CC=CC=C2)CN3C(=S)N=C(N3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H28N4S/c29-24-25-23(14-13-21-9-5-2-6-10-21)26-28(24)19-27-17-15-22(16-18-27)12-11-20-7-3-1-4-8-20/h1-10,13-14,22H,11-12,15-19H2,(H,25,26,29)/b14-13+