N-[5-iodanyl-3,4-bis(oxidanylidene)-1-phenyl-pentan-2-yl]-4-methyl-2-(morpholin-2-ylsulfonylamino)pentanamide

Systemtic Name: N-[5-iodanyl-3,4-bis(oxidanylidene)-1-phenyl-pentan-2-yl]-4-methyl-2-(morpholin-2-ylsulfonylamino)pentanamide Openeye Name: N-(1-benzyl-4-iodo-2,3-dioxo-butyl)-4-methyl-2-(morpholin-2-ylsulfonylamino)pentanamide CAS Name: N-(5-iodo-3,4-dioxo-1-phenylpentan-2-yl)-4-methyl-2-(2-morpholinylsulfonylamino)pentanamide IUPAC Name: N-(5-iodo-3,4-dioxo-1-phenylpentan-2-yl)-4-methyl-2-(morpholin-2-ylsulfonylamino)pentanamide Traditional Name: N-(1-benzyl-4-iodo-2,3-diketo-butyl)-4-methyl-2-(morpholin-2-ylsulfonylamino)valeramide Formula: C21H30IN3O6S MolecularWeight: 579.44887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)C(=O)CI)NS(=O)(=O)C2CNCCO2

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)C(=O)CI)NS(=O)(=O)C2CNCCO2

InChI

InChI=1S/C21H30IN3O6S/c1-14(2)10-17(25-32(29,30)19-13-23-8-9-31-19)21(28)24-16(20(27)18(26)12-22)11-15-6-4-3-5-7-15/h3-7,14,16-17,19,23,25H,8-13H2,1-2H3,(H,24,28)