3-(azepan-1-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione hydrochloride

Systemtic Name: 3-(azepan-1-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione hydrochloride Openeye Name: 3-(azepan-1-ylmethyl)-5-(4-pyridyl)-1,3,4-oxadiazole-2-thione hydrochloride CAS Name: 3-(1-azepanylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione hydrochloride IUPAC Name: 3-(azepan-1-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione hydrochloride Traditional Name: 3-(azepan-1-ylmethyl)-5-(4-pyridyl)-1,3,4-oxadiazole-2-thione hydrochloride Formula: C14H19ClN4OS MolecularWeight: 326.84486

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CN2C(=S)OC(=N2)C3=CC=NC=C3.Cl

Isomeric SMILES

C1CCCN(CC1)CN2C(=S)OC(=N2)C3=CC=NC=C3.Cl

InChI

InChI=1S/C14H18N4OS.ClH/c20-14-18(11-17-9-3-1-2-4-10-17)16-13(19-14)12-5-7-15-8-6-12;/h5-8H,1-4,9-11H2;1H