2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)C4=CC=CN4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)C4=CC=CN4

InChI

InChI=1S/C20H24N4O3S2/c1-2-24-18-9-8-15(29(26,27)23-11-4-3-5-12-23)13-17(18)22-20(24)28-14-19(25)16-7-6-10-21-16/h6-10,13,21H,2-5,11-12,14H2,1H3