2-[4-[4-(benzimidazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[4-(benzimidazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[4-(benzimidazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[[4-(1-benzimidazolyl)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-(benzimidazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[4-(benzimidazol-1-yl)benzoyl]piperazino]sulfonylbenzonitrile Formula: C25H21N5O3S MolecularWeight: 471.53094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5C#N

InChI

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