2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-pyrrolidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-pyrrolidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole Openeye Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-pyrrolidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole CAS Name: 2-[(2-phenoxyethylthio)methyl]-5-[4-[(E)-5-(1-pyrrolidinyl)pent-1-enyl]phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-pyrrolidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole Traditional Name: 2-[(2-phenoxyethylthio)methyl]-5-[4-[(E)-5-pyrrolidinopent-1-enyl]phenyl]-1,3,4-oxadiazole Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCC=CC2=CC=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCC/C=C/C2=CC=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S/c1-4-10-24(11-5-1)30-19-20-32-21-25-27-28-26(31-25)23-14-12-22(13-15-23)9-3-2-6-16-29-17-7-8-18-29/h1,3-5,9-15H,2,6-8,16-21H2/b9-3+