1-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]-3-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]-3-phenylsulfanyl-propan-1-one Openeye Name: 3-phenylsulfanyl-1-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]-3-(phenylthio)-1-propanone IUPAC Name: 1-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]-3-phenylsulfanylpropan-1-one Traditional Name: 3-(phenylthio)-1-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]propan-1-one Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C(=O)CCSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C(=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-18-7-9-19(10-8-18)23-24-21(29-25-23)17-26-12-14-27(15-13-26)22(28)11-16-30-20-5-3-2-4-6-20/h2-10H,11-17H2,1H3