(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(2-phenylethanoylamino)ethanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(2-phenylethanoylamino)ethanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-[(2-phenylacetyl)amino]acetate CAS Name: 2-[(1-oxo-2-phenylethyl)amino]acetic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 2-[(2-phenylacetyl)amino]acetate Traditional Name: 2-[(2-phenylacetyl)amino]acetic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O5S/c1-2-3-11-26-19-10-9-17(32(23,29)30)13-18(19)25-20(26)15-31-22(28)14-24-21(27)12-16-7-5-4-6-8-16/h4-10,13H,2-3,11-12,14-15H2,1H3,(H,24,27)(H2,23,29,30)