1-(4-azanyl-3-nitro-phenyl)-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-(4-azanyl-3-nitro-phenyl)-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(4-amino-3-nitro-phenyl)-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-(4-amino-3-nitrophenyl)-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-(4-amino-3-nitrophenyl)-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-(4-amino-3-nitro-phenyl)-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C14H13FN4O2S MolecularWeight: 320.342023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13FN4O2S/c1-8-2-3-9(6-11(8)15)17-14(22)18-10-4-5-12(16)13(7-10)19(20)21/h2-7H,16H2,1H3,(H2,17,18,22)