3-methyl-2-[2-[(4-sulfamoylphenyl)carbonylamino]ethanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-[(4-sulfamoylphenyl)carbonylamino]ethanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[[oxo-(4-sulfamoylphenyl)methyl]amino]ethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]pentanoic acid Traditional Name: 3-methyl-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]valeric acid Formula: C15H21N3O6S MolecularWeight: 371.40874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C15H21N3O6S/c1-3-9(2)13(15(21)22)18-12(19)8-17-14(20)10-4-6-11(7-5-10)25(16,23)24/h4-7,9,13H,3,8H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)(H2,16,23,24)