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

Systemtic Name: 5-[2,3-bis(chloranyl)phenyl]-N-[(2-methyl-4-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(2,3-dichlorophenyl)-N-[(2-methyl-4-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(2,3-dichlorophenyl)-N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(2,3-dichlorophenyl)-N-[(2-methyl-4-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(2,3-dichlorophenyl)-N-[(2-methyl-4-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C19H13Cl2N3O4S MolecularWeight: 450.29522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=C(O2)C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=C(O2)C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C19H13Cl2N3O4S/c1-10-9-11(24(26)27)5-6-14(10)22-19(29)23-18(25)16-8-7-15(28-16)12-3-2-4-13(20)17(12)21/h2-9H,1H3,(H2,22,23,25,29)