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

Systemtic Name: (4-tert-butylphenyl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]methanone Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O2S/c1-22(2,3)18-6-4-16(5-7-18)21(27)26-11-9-25(10-12-26)14-19-23-20(24-28-19)17-8-13-29-15-17/h4-8,13,15H,9-12,14H2,1-3H3