3-cyclohexyl-N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[(2-fluoro-5-nitrophenyl)carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]propionamide Formula: C16H20FN3O3S MolecularWeight: 353.411703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C16H20FN3O3S/c17-13-8-7-12(20(22)23)10-14(13)18-16(24)19-15(21)9-6-11-4-2-1-3-5-11/h7-8,10-11H,1-6,9H2,(H2,18,19,21,24)