1-(4-bromanyl-2-chloranyl-phenyl)-3-(4-fluoranyl-3-nitro-phenyl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(4-fluoranyl-3-nitro-phenyl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-fluoro-3-nitro-phenyl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(4-fluoro-3-nitrophenyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(4-fluoro-3-nitrophenyl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-fluoro-3-nitro-phenyl)thiourea Formula: C13H8BrClFN3O2S MolecularWeight: 404.641923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8BrClFN3O2S/c14-7-1-4-11(9(15)5-7)18-13(22)17-8-2-3-10(16)12(6-8)19(20)21/h1-6H,(H2,17,18,22)