(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-methyl-1-benzofuran-2-carboxylate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C5=CC=CC=C5O4)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C5=CC=CC=C5O4)C

InChI

InChI=1S/C25H27N3O6S/c1-3-10-28-21-9-8-18(35(30,31)27-11-13-32-14-12-27)15-20(21)26-23(28)16-33-25(29)24-17(2)19-6-4-5-7-22(19)34-24/h4-9,15H,3,10-14,16H2,1-2H3