1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylsulfanyl-ethanone CAS Name: 1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-2-(phenylthio)ethanone IUPAC Name: 1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylsulfanylethanone Traditional Name: 1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidino]-2-(phenylthio)ethanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)C3CCCN3C(=O)CSC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)C3CCCN3C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S/c1-26-16-11-9-15(10-12-16)20-22-21(27-23-20)18-8-5-13-24(18)19(25)14-28-17-6-3-2-4-7-17/h2-4,6-7,9-12,18H,5,8,13-14H2,1H3