1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoranyl-5-iodanyl-4-(methylsulfonylamino)phenyl]methyl]urea

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoranyl-5-iodanyl-4-(methylsulfonylamino)phenyl]methyl]urea Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoro-5-iodo-4-(methanesulfonamido)phenyl]methyl]urea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoro-5-iodo-4-(methanesulfonamido)phenyl]methyl]urea IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoro-5-iodo-4-(methanesulfonamido)phenyl]methyl]urea Traditional Name: 1-(4-tert-butylbenzyl)-3-[3-fluoro-5-iodo-4-(methanesulfonamido)benzyl]urea Formula: C20H25FIN3O3S MolecularWeight: 533.398673

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=O)NCC2=CC(=C(C(=C2)I)NS(=O)(=O)C)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=O)NCC2=CC(=C(C(=C2)I)NS(=O)(=O)C)F

InChI

InChI=1S/C20H25FIN3O3S/c1-20(2,3)15-7-5-13(6-8-15)11-23-19(26)24-12-14-9-16(21)18(17(22)10-14)25-29(4,27)28/h5-10,25H,11-12H2,1-4H3,(H2,23,24,26)