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

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-(5-nitro-2-oxidanyl-phenyl)thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-(2-hydroxy-5-nitro-phenyl)thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-(2-hydroxy-5-nitrophenyl)thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-(2-hydroxy-5-nitrophenyl)thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-(2-hydroxy-5-nitro-phenyl)thiourea Formula: C14H12FN3O3S MolecularWeight: 321.326783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)F

InChI

InChI=1S/C14H12FN3O3S/c1-8-2-3-9(6-11(8)15)16-14(22)17-12-7-10(18(20)21)4-5-13(12)19/h2-7,19H,1H3,(H2,16,17,22)