(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2,3-dimethylbenzoate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2,3-dimethylbenzoate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl 2,3-dimethylbenzoate CAS Name: 2,3-dimethylbenzoic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl 2,3-dimethylbenzoate Traditional Name: 2,3-dimethylbenzoic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C24H29N3O5S MolecularWeight: 471.56916

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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(C(=CC=C4)C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O5S/c1-4-10-27-22-9-8-19(33(29,30)26-11-13-31-14-12-26)15-21(22)25-23(27)16-32-24(28)20-7-5-6-17(2)18(20)3/h5-9,15H,4,10-14,16H2,1-3H3