N-(4-bromanyl-2-fluoranyl-phenyl)-2-oxidanylidene-cyclohexane-1-carbothioamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-oxidanylidene-cyclohexane-1-carbothioamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-oxo-cyclohexanecarbothioamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-oxo-1-cyclohexanecarbothioamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-oxocyclohexane-1-carbothioamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-keto-cyclohexanecarbothioamide Formula: C13H13BrFNOS MolecularWeight: 330.215823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)C(=S)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CCC(=O)C(C1)C(=S)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H13BrFNOS/c14-8-5-6-11(10(15)7-8)16-13(18)9-3-1-2-4-12(9)17/h5-7,9H,1-4H2,(H,16,18)