3-[5-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-2-yl]-1,2,4-oxadiazol-3-yl]benzenecarbonitrile

Systemtic Name: 3-[5-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-2-yl]-1,2,4-oxadiazol-3-yl]benzenecarbonitrile Openeye Name: 3-[5-[1-(1,3-benzothiazol-2-ylmethyl)-2-piperidyl]-1,2,4-oxadiazol-3-yl]benzonitrile CAS Name: 3-[5-[1-(1,3-benzothiazol-2-ylmethyl)-2-piperidinyl]-1,2,4-oxadiazol-3-yl]benzonitrile IUPAC Name: 3-[5-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-2-yl]-1,2,4-oxadiazol-3-yl]benzonitrile Traditional Name: 3-[5-[1-(1,3-benzothiazol-2-ylmethyl)-2-piperidyl]-1,2,4-oxadiazol-3-yl]benzonitrile Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC(=NO2)C3=CC=CC(=C3)C#N)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C(C1)C2=NC(=NO2)C3=CC=CC(=C3)C#N)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N5OS/c23-13-15-6-5-7-16(12-15)21-25-22(28-26-21)18-9-3-4-11-27(18)14-20-24-17-8-1-2-10-19(17)29-20/h1-2,5-8,10,12,18H,3-4,9,11,14H2