5-chloranyl-3-[2-[2-(morpholin-4-ylmethyl)-3-phenyl-piperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 5-chloranyl-3-[2-[2-(morpholin-4-ylmethyl)-3-phenyl-piperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 5-chloro-3-[2-[2-(morpholinomethyl)-3-phenyl-1-piperidyl]-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 5-chloro-3-[2-[2-(4-morpholinylmethyl)-3-phenyl-1-piperidinyl]-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 5-chloro-3-[2-[2-(morpholin-4-ylmethyl)-3-phenylpiperidin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 5-chloro-3-[2-keto-2-[2-(morpholinomethyl)-3-phenyl-piperidino]ethyl]-1,3-benzothiazol-2-one Formula: C25H28ClN3O3S MolecularWeight: 486.02612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O)CN4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(C(N(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O)CN4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H28ClN3O3S/c26-19-8-9-23-21(15-19)29(25(31)33-23)17-24(30)28-10-4-7-20(18-5-2-1-3-6-18)22(28)16-27-11-13-32-14-12-27/h1-3,5-6,8-9,15,20,22H,4,7,10-14,16-17H2