1-tert-butyl-3-[(4-fluoranyl-3-nitro-phenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(4-fluoranyl-3-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(4-fluoro-3-nitro-benzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[(4-fluoro-3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(4-fluoro-3-nitrobenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(4-fluoro-3-nitro-benzoyl)amino]thiourea Formula: C12H15FN4O3S MolecularWeight: 314.335903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C12H15FN4O3S/c1-12(2,3)14-11(21)16-15-10(18)7-4-5-8(13)9(6-7)17(19)20/h4-6H,1-3H3,(H,15,18)(H2,14,16,21)