3-chloranyl-5-(4-phenylmethoxypiperidin-1-yl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-chloranyl-5-(4-phenylmethoxypiperidin-1-yl)-1,2-thiazole-4-carbonitrile Openeye Name: 5-(4-benzyloxy-1-piperidyl)-3-chloro-isothiazole-4-carbonitrile CAS Name: 3-chloro-5-(4-phenylmethoxy-1-piperidinyl)-4-isothiazolecarbonitrile IUPAC Name: 3-chloro-5-(4-phenylmethoxypiperidin-1-yl)-1,2-thiazole-4-carbonitrile Traditional Name: 5-(4-benzoxypiperidino)-3-chloro-isothiazole-4-carbonitrile Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC2=CC=CC=C2)C3=C(C(=NS3)Cl)C#N

Isomeric SMILES

C1CN(CCC1OCC2=CC=CC=C2)C3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C16H16ClN3OS/c17-15-14(10-18)16(22-19-15)20-8-6-13(7-9-20)21-11-12-4-2-1-3-5-12/h1-5,13H,6-9,11H2