ethyl 1-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]isonipecotic acid ethyl ester Formula: C23H34N4O4S MolecularWeight: 462.60546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C23H34N4O4S/c1-3-27-21-9-8-19(32(29,30)26-12-6-5-7-13-26)16-20(21)24-22(27)17-25-14-10-18(11-15-25)23(28)31-4-2/h8-9,16,18H,3-7,10-15,17H2,1-2H3