1-(4-fluorophenyl)-3-(5-nitro-2-oxidanyl-phenyl)thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-(5-nitro-2-oxidanyl-phenyl)thiourea Openeye Name: 1-(4-fluorophenyl)-3-(2-hydroxy-5-nitro-phenyl)thiourea CAS Name: 1-(4-fluorophenyl)-3-(2-hydroxy-5-nitrophenyl)thiourea IUPAC Name: 1-(4-fluorophenyl)-3-(2-hydroxy-5-nitrophenyl)thiourea Traditional Name: 1-(4-fluorophenyl)-3-(2-hydroxy-5-nitro-phenyl)thiourea Formula: C13H10FN3O3S MolecularWeight: 307.300203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)F

InChI

InChI=1S/C13H10FN3O3S/c14-8-1-3-9(4-2-8)15-13(21)16-11-7-10(17(19)20)5-6-12(11)18/h1-7,18H,(H2,15,16,21)