1-ethyl-2-[(1-ethylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 1-ethyl-2-[(1-ethylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-2-[(1-ethylimidazol-2-yl)sulfanylmethyl]-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 1-ethyl-2-[[(1-ethyl-2-imidazolyl)thio]methyl]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[(1-ethylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-2-[[(1-ethylimidazol-2-yl)thio]methyl]-5-piperidinosulfonyl-benzimidazole Formula: C20H27N5O2S2 MolecularWeight: 433.59068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCN1C=CN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H27N5O2S2/c1-3-23-13-10-21-20(23)28-15-19-22-17-14-16(8-9-18(17)25(19)4-2)29(26,27)24-11-6-5-7-12-24/h8-10,13-14H,3-7,11-12,15H2,1-2H3