5-azanyl-5-oxidanylidene-2-[2-[2-[(4-sulfamoylphenyl)carbonylamino]ethanoylamino]ethanoylamino]pentanoic acid

Systemtic Name: 5-azanyl-5-oxidanylidene-2-[2-[2-[(4-sulfamoylphenyl)carbonylamino]ethanoylamino]ethanoylamino]pentanoic acid Openeye Name: 5-amino-5-oxo-2-[[2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]acetyl]amino]pentanoic acid CAS Name: 5-amino-5-oxo-2-[[1-oxo-2-[[1-oxo-2-[[oxo-(4-sulfamoylphenyl)methyl]amino]ethyl]amino]ethyl]amino]pentanoic acid IUPAC Name: 5-amino-5-oxo-2-[[2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]acetyl]amino]pentanoic acid Traditional Name: 5-amino-5-keto-2-[[2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]acetyl]amino]valeric acid Formula: C16H21N5O8S MolecularWeight: 443.43164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)NC(CCC(=O)N)C(=O)O)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)NC(CCC(=O)N)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C16H21N5O8S/c17-12(22)6-5-11(16(26)27)21-14(24)8-19-13(23)7-20-15(25)9-1-3-10(4-2-9)30(18,28)29/h1-4,11H,5-8H2,(H2,17,22)(H,19,23)(H,20,25)(H,21,24)(H,26,27)(H2,18,28,29)