(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl 1-benzofuran-2-carboxylate

Systemtic Name: (1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl 1-benzofuran-2-carboxylate Openeye Name: [1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C24H25N3O5S/c1-2-27-20-11-10-18(33(29,30)26-12-6-3-7-13-26)15-19(20)25-23(27)16-31-24(28)22-14-17-8-4-5-9-21(17)32-22/h4-5,8-11,14-15H,2-3,6-7,12-13,16H2,1H3