4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]methyl]benzonitrile IUPAC Name: 4-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]methyl]benzonitrile Formula: C22H24N4O2S2 MolecularWeight: 440.58156

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CC=C(C=C4)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H24N4O2S2/c1-2-26-21-11-10-19(30(27,28)25-12-4-3-5-13-25)14-20(21)24-22(26)29-16-18-8-6-17(15-23)7-9-18/h6-11,14H,2-5,12-13,16H2,1H3