4-[4-[4-(benzimidazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[4-(benzimidazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[4-(benzimidazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[[4-(1-benzimidazolyl)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[4-(benzimidazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[4-(benzimidazol-1-yl)benzoyl]piperazino]sulfonylbenzonitrile Formula: C25H21N5O3S MolecularWeight: 471.53094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H21N5O3S/c26-17-19-5-11-22(12-6-19)34(32,33)29-15-13-28(14-16-29)25(31)20-7-9-21(10-8-20)30-18-27-23-3-1-2-4-24(23)30/h1-12,18H,13-16H2