1-(3-fluorophenyl)-3-(2-methoxy-5-nitro-phenyl)thiourea

Systemtic Name: 1-(3-fluorophenyl)-3-(2-methoxy-5-nitro-phenyl)thiourea Openeye Name: 1-(3-fluorophenyl)-3-(2-methoxy-5-nitro-phenyl)thiourea CAS Name: 1-(3-fluorophenyl)-3-(2-methoxy-5-nitrophenyl)thiourea IUPAC Name: 1-(3-fluorophenyl)-3-(2-methoxy-5-nitrophenyl)thiourea Traditional Name: 1-(3-fluorophenyl)-3-(2-methoxy-5-nitro-phenyl)thiourea Formula: C14H12FN3O3S MolecularWeight: 321.326783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)F

InChI

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