5-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]-3-(3-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(4-bromophenyl)sulfonyl-1-piperazinyl]methyl]-3-(3-thiophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Traditional Name: 5-[(4-brosylpiperazino)methyl]-3-(3-thienyl)-1,2,4-oxadiazole Formula: C17H17BrN4O3S2 MolecularWeight: 469.37588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NO2)C3=CSC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=NC(=NO2)C3=CSC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H17BrN4O3S2/c18-14-1-3-15(4-2-14)27(23,24)22-8-6-21(7-9-22)11-16-19-17(20-25-16)13-5-10-26-12-13/h1-5,10,12H,6-9,11H2