2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 2-[[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-ethylpiperazino)propan-1-one Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(C)SC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H30N4O2S/c1-6-24-11-13-25(14-12-24)19(26)15(2)28-20-23-22-18(27-20)16-7-9-17(10-8-16)21(3,4)5/h7-10,15H,6,11-14H2,1-5H3