3-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanenitrile Openeye Name: 3-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylpropanenitrile CAS Name: 3-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]propanenitrile IUPAC Name: 3-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]propionitrile Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCCC#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCCC#N

InChI

InChI=1S/C17H22N4O2S2/c1-2-21-16-8-7-14(25(22,23)20-10-4-3-5-11-20)13-15(16)19-17(21)24-12-6-9-18/h7-8,13H,2-6,10-12H2,1H3