1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-phenyl-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-phenyl-2-phenylsulfanyl-ethanone Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-phenyl-2-phenylsulfanyl-ethanone CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-phenyl-2-(phenylthio)ethanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-phenyl-2-phenylsulfanylethanone Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-phenyl-2-(phenylthio)ethanone Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C(C4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C(C4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O2S/c29-26(24(19-9-3-1-4-10-19)31-21-11-5-2-6-12-21)28-17-15-20(16-18-28)25-27-22-13-7-8-14-23(22)30-25/h1-14,20,24H,15-18H2