1-[2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone CAS Name: 1-[2-(5-phenyl-1,3-benzoxazol-2-yl)-1-pyrrolidinyl]-2-(phenylthio)ethanone IUPAC Name: 1-[2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-2-phenylsulfanylethanone Traditional Name: 1-[2-(5-phenyl-1,3-benzoxazol-2-yl)pyrrolidino]-2-(phenylthio)ethanone Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=CC=CC=C2)C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)CSC2=CC=CC=C2)C3=NC4=C(O3)C=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N2O2S/c28-24(17-30-20-10-5-2-6-11-20)27-15-7-12-22(27)25-26-21-16-19(13-14-23(21)29-25)18-8-3-1-4-9-18/h1-6,8-11,13-14,16,22H,7,12,15,17H2