1-[4-(4-nitrophenyl)piperazin-1-yl]-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanone Openeye Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(2-thiazol-4-ylbenzimidazol-1-yl)ethanone CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-2-[2-(4-thiazolyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanone Traditional Name: 1-[4-(4-nitrophenyl)piperazino]-2-(2-thiazol-4-ylbenzimidazol-1-yl)ethanone Formula: C22H20N6O3S MolecularWeight: 448.4976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CN3C4=CC=CC=C4N=C3C5=CSC=N5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CN3C4=CC=CC=C4N=C3C5=CSC=N5

InChI

InChI=1S/C22H20N6O3S/c29-21(26-11-9-25(10-12-26)16-5-7-17(8-6-16)28(30)31)13-27-20-4-2-1-3-18(20)24-22(27)19-14-32-15-23-19/h1-8,14-15H,9-13H2