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

Systemtic Name: 3-(2-chlorophenyl)-N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[(2-fluoro-5-nitrophenyl)carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]propionamide Formula: C16H13ClFN3O3S MolecularWeight: 381.809123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClFN3O3S/c17-12-4-2-1-3-10(12)5-8-15(22)20-16(25)19-14-9-11(21(23)24)6-7-13(14)18/h1-4,6-7,9H,5,8H2,(H2,19,20,22,25)