5-chloranyl-3-[2-oxidanylidene-2-[3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 5-chloranyl-3-[2-oxidanylidene-2-[3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-1,3-benzothiazol-2-one Openeye Name: 5-chloro-3-[2-oxo-2-[3-phenyl-2-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethyl]-1,3-benzothiazol-2-one CAS Name: 5-chloro-3-[2-oxo-2-[3-phenyl-2-(1-pyrrolidinylmethyl)-1-piperidinyl]ethyl]-1,3-benzothiazol-2-one IUPAC Name: 5-chloro-3-[2-oxo-2-[3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-1,3-benzothiazol-2-one Traditional Name: 5-chloro-3-[2-keto-2-[3-phenyl-2-(pyrrolidinomethyl)piperidino]ethyl]-1,3-benzothiazol-2-one Formula: C25H28ClN3O2S MolecularWeight: 470.02672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C(CCCN2C(=O)CN3C4=C(C=CC(=C4)Cl)SC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CC2C(CCCN2C(=O)CN3C4=C(C=CC(=C4)Cl)SC3=O)C5=CC=CC=C5

InChI

InChI=1S/C25H28ClN3O2S/c26-19-10-11-23-21(15-19)29(25(31)32-23)17-24(30)28-14-6-9-20(18-7-2-1-3-8-18)22(28)16-27-12-4-5-13-27/h1-3,7-8,10-11,15,20,22H,4-6,9,12-14,16-17H2