1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3-nitrophenyl)amino]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3-nitrophenyl)amino]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(3-nitroanilino)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(3-nitroanilino)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(3-nitroanilino)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(3-nitroanilino)thiourea Formula: C13H10ClFN4O2S MolecularWeight: 340.760503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClFN4O2S/c14-11-7-8(4-5-12(11)15)16-13(22)18-17-9-2-1-3-10(6-9)19(20)21/h1-7,17H,(H2,16,18,22)