4-[(2-methylsulfonylbenzimidazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-methylsulfonylbenzimidazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(2-methylsulfonylbenzimidazol-1-yl)methyl]benzonitrile CAS Name: 4-[(2-methylsulfonyl-1-benzimidazolyl)methyl]benzonitrile IUPAC Name: 4-[(2-methylsulfonylbenzimidazol-1-yl)methyl]benzonitrile Traditional Name: 4-[(2-mesylbenzimidazol-1-yl)methyl]benzonitrile Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N3O2S/c1-22(20,21)16-18-14-4-2-3-5-15(14)19(16)11-13-8-6-12(10-17)7-9-13/h2-9H,11H2,1H3