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

Systemtic Name: 5-(3,4-dichlorophenyl)-N-[(2-methyl-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dichlorophenyl)-N-[(2-methyl-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dichlorophenyl)-N-[(2-methyl-3-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dichlorophenyl)-N-[(2-methyl-3-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dichlorophenyl)-N-[(2-methyl-3-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=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

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

InChI

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