5-(3-chloranyl-2-methyl-phenyl)-N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-chloranyl-2-methyl-phenyl)-N-[(4-fluoranyl-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-chloro-2-methyl-phenyl)-N-[(4-fluoro-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-chloro-2-methylphenyl)-N-[(4-fluoro-3-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-chloro-2-methylphenyl)-N-[(4-fluoro-3-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-chloro-2-methyl-phenyl)-N-[(4-fluoro-3-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C19H13ClFN3O4S MolecularWeight: 433.840623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H13ClFN3O4S/c1-10-12(3-2-4-13(10)20)16-7-8-17(28-16)18(25)23-19(29)22-11-5-6-14(21)15(9-11)24(26)27/h2-9H,1H3,(H2,22,23,25,29)