ethyl 1-ethyl-2-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[4-(1-piperidylsulfonyl)phenyl]ethyl]benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[2-[4-(1-piperidinylsulfonyl)phenyl]ethyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[2-(4-piperidinosulfonylphenyl)ethyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H31N3O4S/c1-3-28-23-14-11-20(25(29)32-4-2)18-22(23)26-24(28)15-10-19-8-12-21(13-9-19)33(30,31)27-16-6-5-7-17-27/h8-9,11-14,18H,3-7,10,15-17H2,1-2H3