1-tert-butyl-3-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]thiourea

Systemtic Name: 1-tert-butyl-3-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]thiourea Openeye Name: 1-tert-butyl-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea CAS Name: 1-tert-butyl-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea IUPAC Name: 1-tert-butyl-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea Traditional Name: 1-tert-butyl-3-[3-fluoro-4-(methanesulfonamido)benzyl]thiourea Formula: C13H20FN3O2S2 MolecularWeight: 333.445203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NCC1=CC(=C(C=C1)NS(=O)(=O)C)F

Isomeric SMILES

CC(C)(C)NC(=S)NCC1=CC(=C(C=C1)NS(=O)(=O)C)F

InChI

InChI=1S/C13H20FN3O2S2/c1-13(2,3)16-12(20)15-8-9-5-6-11(10(14)7-9)17-21(4,18)19/h5-7,17H,8H2,1-4H3,(H2,15,16,20)