4-[(1R)-1-phenylethyl]-3-[(2-pyridin-2-ylbenzimidazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(1R)-1-phenylethyl]-3-[(2-pyridin-2-ylbenzimidazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(1R)-1-phenylethyl]-3-[[2-(2-pyridyl)benzimidazol-1-yl]methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(1R)-1-phenylethyl]-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(1R)-1-phenylethyl]-3-[(2-pyridin-2-ylbenzimidazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(1R)-1-phenylethyl]-3-[[2-(2-pyridyl)benzimidazol-1-yl]methyl]-1H-1,2,4-triazole-5-thione Formula: C23H20N6S MolecularWeight: 412.5101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=NNC2=S)CN3C4=CC=CC=C4N=C3C5=CC=CC=N5

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=NNC2=S)CN3C4=CC=CC=C4N=C3C5=CC=CC=N5

InChI

InChI=1S/C23H20N6S/c1-16(17-9-3-2-4-10-17)29-21(26-27-23(29)30)15-28-20-13-6-5-11-18(20)25-22(28)19-12-7-8-14-24-19/h2-14,16H,15H2,1H3,(H,27,30)/t16-/m1/s1