(4-chloranyl-2-methyl-phenyl) 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanoate Openeye Name: (4-chloro-2-methyl-phenyl) 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanoate CAS Name: 3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]propanoic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoate Traditional Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)propionic acid (4-chloro-2-methyl-phenyl) ester Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)OC4=C(C=C(C=C4)Cl)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)OC4=C(C=C(C=C4)Cl)C

InChI

InChI=1S/C23H26ClN3O5S/c1-3-27-20-6-5-18(33(29,30)26-10-12-31-13-11-26)15-19(20)25-22(27)8-9-23(28)32-21-7-4-17(24)14-16(21)2/h4-7,14-15H,3,8-13H2,1-2H3