2-[2-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[2-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[2-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethoxy]benzonitrile Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)COC4=CC=CC=C4C#N

Isomeric SMILES

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)COC4=CC=CC=C4C#N

InChI

InChI=1S/C21H19N3O2S/c22-13-15-7-1-3-10-18(15)26-14-20(25)24-12-6-5-9-17(24)21-23-16-8-2-4-11-19(16)27-21/h1-4,7-8,10-11,17H,5-6,9,12,14H2