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

Systemtic Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methoxy]benzenecarbonitrile Openeye Name: 2-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methoxy]benzonitrile CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methoxy]benzonitrile IUPAC Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methoxy]benzonitrile Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methoxy]benzonitrile Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC4=CC=CC=C4C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC4=CC=CC=C4C#N

InChI

InChI=1S/C22H24N4O3S/c1-2-26-20-11-10-18(30(27,28)25-12-6-3-7-13-25)14-19(20)24-22(26)16-29-21-9-5-4-8-17(21)15-23/h4-5,8-11,14H,2-3,6-7,12-13,16H2,1H3