(3-methylquinoxalin-2-yl)methyl 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate CAS Name: 3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoate Traditional Name: 3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)CCC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)CCC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C23H25N5O4S/c1-15-20(25-18-8-6-5-7-17(18)24-15)14-32-23(29)12-11-22-26-19-13-16(33(30,31)27(2)3)9-10-21(19)28(22)4/h5-10,13H,11-12,14H2,1-4H3