2-[2-[4-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]ethylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[2-[4-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]ethylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[2-[4-[(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]ethylsulfanyl]-1,3-benzothiazole CAS Name: 2-[2-[4-[(4-chlorophenyl)-(2-pyridinyl)methoxy]-1-piperidinyl]ethylthio]-1,3-benzothiazole IUPAC Name: 2-[2-[4-[(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]ethylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[2-[4-[(4-chlorophenyl)-(2-pyridyl)methoxy]piperidino]ethylthio]-1,3-benzothiazole Formula: C26H26ClN3OS2 MolecularWeight: 496.08714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(C2=CC=C(C=C2)Cl)C3=CC=CC=N3)CCSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCC1OC(C2=CC=C(C=C2)Cl)C3=CC=CC=N3)CCSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H26ClN3OS2/c27-20-10-8-19(9-11-20)25(23-6-3-4-14-28-23)31-21-12-15-30(16-13-21)17-18-32-26-29-22-5-1-2-7-24(22)33-26/h1-11,14,21,25H,12-13,15-18H2