ethyl 1-cyclohexyl-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-cyclohexyl-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-cyclohexyl-2-[1-(p-tolylsulfonyl)-4-piperidyl]benzimidazole-5-carboxylate CAS Name: 1-cyclohexyl-2-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclohexyl-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzimidazole-5-carboxylate Traditional Name: 1-cyclohexyl-2-(1-tosyl-4-piperidyl)benzimidazole-5-carboxylic acid ethyl ester Formula: C28H35N3O4S MolecularWeight: 509.6602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)C5CCCCC5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)C5CCCCC5

InChI

InChI=1S/C28H35N3O4S/c1-3-35-28(32)22-11-14-26-25(19-22)29-27(31(26)23-7-5-4-6-8-23)21-15-17-30(18-16-21)36(33,34)24-12-9-20(2)10-13-24/h9-14,19,21,23H,3-8,15-18H2,1-2H3