N-[4-[4-(2-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-[4-(2-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[4-[4-[(2-bromophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetamide IUPAC Name: N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-[4-[4-(2-bromobenzoyl)piperazino]phenyl]-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C27H23BrN6O5S MolecularWeight: 623.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C27H23BrN6O5S/c28-23-7-2-1-6-22(23)26(36)33-14-12-32(13-15-33)20-10-8-19(9-11-20)29-24(35)17-40-27-31-30-25(39-27)18-4-3-5-21(16-18)34(37)38/h1-11,16H,12-15,17H2,(H,29,35)