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

Systemtic Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-piperidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole Openeye Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-(1-piperidyl)pent-1-enyl]phenyl]-1,3,4-oxadiazole CAS Name: 2-[(2-phenoxyethylthio)methyl]-5-[4-[(E)-5-(1-piperidinyl)pent-1-enyl]phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-phenoxyethylsulfanylmethyl)-5-[4-[(E)-5-piperidin-1-ylpent-1-enyl]phenyl]-1,3,4-oxadiazole Traditional Name: 2-[(2-phenoxyethylthio)methyl]-5-[4-[(E)-5-piperidinopent-1-enyl]phenyl]-1,3,4-oxadiazole Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCC=CC2=CC=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCC/C=C/C2=CC=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2S/c1-5-11-25(12-6-1)31-20-21-33-22-26-28-29-27(32-26)24-15-13-23(14-16-24)10-4-2-7-17-30-18-8-3-9-19-30/h1,4-6,10-16H,2-3,7-9,17-22H2/b10-4+