4-[(1R,2R)-2-phenylmethoxycyclopentyl]-3-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(1R,2R)-2-phenylmethoxycyclopentyl]-3-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(1R,2R)-2-benzyloxycyclopentyl]-3-(2-pyridylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(1R,2R)-2-phenylmethoxycyclopentyl]-3-(2-pyridinylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(1R,2R)-2-phenylmethoxycyclopentyl]-3-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(1R,2R)-2-benzoxycyclopentyl]-3-(2-pyridylmethyl)-1H-1,2,4-triazole-5-thione Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)OCC2=CC=CC=C2)N3C(=NNC3=S)CC4=CC=CC=N4

Isomeric SMILES

C1C[C@H]([C@@H](C1)OCC2=CC=CC=C2)N3C(=NNC3=S)CC4=CC=CC=N4

InChI

InChI=1S/C20H22N4OS/c26-20-23-22-19(13-16-9-4-5-12-21-16)24(20)17-10-6-11-18(17)25-14-15-7-2-1-3-8-15/h1-5,7-9,12,17-18H,6,10-11,13-14H2,(H,23,26)/t17-,18-/m1/s1