5-(1,3-benzothiazol-2-yl)-2-(2-chloranylphenoxy)-3-oxidanylidene-2-piperidin-1-ylcarbonyl-pentanenitrile

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-(2-chloranylphenoxy)-3-oxidanylidene-2-piperidin-1-ylcarbonyl-pentanenitrile Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-(2-chlorophenoxy)-3-oxo-2-(piperidine-1-carbonyl)pentanenitrile CAS Name: 5-(1,3-benzothiazol-2-yl)-2-(2-chlorophenoxy)-3-oxo-2-[oxo(1-piperidinyl)methyl]pentanenitrile IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-(2-chlorophenoxy)-3-oxo-2-(piperidine-1-carbonyl)pentanenitrile Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-(2-chlorophenoxy)-3-keto-2-(piperidine-1-carbonyl)valeronitrile Formula: C24H22ClN3O3S MolecularWeight: 467.96778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C#N)(C(=O)CCC2=NC3=CC=CC=C3S2)OC4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C(C#N)(C(=O)CCC2=NC3=CC=CC=C3S2)OC4=CC=CC=C4Cl

InChI

InChI=1S/C24H22ClN3O3S/c25-17-8-2-4-10-19(17)31-24(16-26,23(30)28-14-6-1-7-15-28)21(29)12-13-22-27-18-9-3-5-11-20(18)32-22/h2-5,8-11H,1,6-7,12-15H2