2-[(2-acetamido-4-azanyl-4-oxidanylidene-butanoyl)amino]-N-[1-(4-iodophenyl)-3-oxidanylidene-butan-2-yl]pentanediamide

Systemtic Name: 2-[(2-acetamido-4-azanyl-4-oxidanylidene-butanoyl)amino]-N-[1-(4-iodophenyl)-3-oxidanylidene-butan-2-yl]pentanediamide Openeye Name: 2-[(2-acetamido-4-amino-4-oxo-butanoyl)amino]-N-[1-[(4-iodophenyl)methyl]-2-oxo-propyl]pentanediamide CAS Name: 2-[(2-acetamido-4-amino-1,4-dioxobutyl)amino]-N-[1-(4-iodophenyl)-3-oxobutan-2-yl]pentanediamide IUPAC Name: 2-[(2-acetamido-4-amino-4-oxobutanoyl)amino]-N-[1-(4-iodophenyl)-3-oxobutan-2-yl]pentanediamide Traditional Name: 2-[(2-acetamido-4-amino-4-keto-butanoyl)amino]-N-[1-(4-iodobenzyl)-2-keto-propyl]glutaramide Formula: C21H28IN5O6 MolecularWeight: 573.38139

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=C(C=C1)I)NC(=O)C(CCC(=O)N)NC(=O)C(CC(=O)N)NC(=O)C

Isomeric SMILES

CC(=O)C(CC1=CC=C(C=C1)I)NC(=O)C(CCC(=O)N)NC(=O)C(CC(=O)N)NC(=O)C

InChI

InChI=1S/C21H28IN5O6/c1-11(28)16(9-13-3-5-14(22)6-4-13)27-20(32)15(7-8-18(23)30)26-21(33)17(10-19(24)31)25-12(2)29/h3-6,15-17H,7-10H2,1-2H3,(H2,23,30)(H2,24,31)(H,25,29)(H,26,33)(H,27,32)