3-(4-tert-butylphenyl)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-tert-butylphenyl)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(4-tert-butylphenyl)-1-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(4-tert-butylphenyl)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-tert-butylphenyl)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(4-tert-butylphenyl)-1-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]propan-1-one Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C24H30N4O2S/c1-24(2,3)19-9-6-18(7-10-19)8-11-22(29)28-14-12-27(13-15-28)17-21-25-23(26-30-21)20-5-4-16-31-20/h4-7,9-10,16H,8,11-15,17H2,1-3H3