N-(2-bromanyl-3-fluoranyl-phenyl)-3-methyl-4-nitro-benzenecarbothioamide

Systemtic Name: N-(2-bromanyl-3-fluoranyl-phenyl)-3-methyl-4-nitro-benzenecarbothioamide Openeye Name: N-(2-bromo-3-fluoro-phenyl)-3-methyl-4-nitro-benzenecarbothioamide CAS Name: N-(2-bromo-3-fluorophenyl)-3-methyl-4-nitrobenzenecarbothioamide IUPAC Name: N-(2-bromo-3-fluorophenyl)-3-methyl-4-nitrobenzenecarbothioamide Traditional Name: N-(2-bromo-3-fluoro-phenyl)-3-methyl-4-nitro-thiobenzamide Formula: C14H10BrFN2O2S MolecularWeight: 369.208803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrFN2O2S/c1-8-7-9(5-6-12(8)18(19)20)14(21)17-11-4-2-3-10(16)13(11)15/h2-7H,1H3,(H,17,21)