2-(2-phenoxyethylsulfanylmethyl)-5-[6-(pyrrolidin-1-ylmethyl)naphthalen-2-yl]-1,3,4-oxadiazole

Systemtic Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[6-(pyrrolidin-1-ylmethyl)naphthalen-2-yl]-1,3,4-oxadiazole Openeye Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[6-(pyrrolidin-1-ylmethyl)-2-naphthyl]-1,3,4-oxadiazole CAS Name: 2-[(2-phenoxyethylthio)methyl]-5-[6-(1-pyrrolidinylmethyl)-2-naphthalenyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[6-(pyrrolidin-1-ylmethyl)naphthalen-2-yl]-1,3,4-oxadiazole Traditional Name: 2-[(2-phenoxyethylthio)methyl]-5-[6-(pyrrolidinomethyl)-2-naphthyl]-1,3,4-oxadiazole Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC3=C(C=C2)C=C(C=C3)C4=NN=C(O4)CSCCOC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CC2=CC3=C(C=C2)C=C(C=C3)C4=NN=C(O4)CSCCOC5=CC=CC=C5

InChI

InChI=1S/C26H27N3O2S/c1-2-6-24(7-3-1)30-14-15-32-19-25-27-28-26(31-25)23-11-10-21-16-20(8-9-22(21)17-23)18-29-12-4-5-13-29/h1-3,6-11,16-17H,4-5,12-15,18-19H2