5-(3-nitrophenyl)-N-[(2-sulfanylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-nitrophenyl)-N-[(2-sulfanylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-nitrophenyl)-N-[(2-sulfanylphenyl)carbamothioyl]furan-2-carboxamide CAS Name: N-[(2-mercaptoanilino)-sulfanylidenemethyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: 5-(3-nitrophenyl)-N-[(2-sulfanylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: N-[(2-mercaptophenyl)thiocarbamoyl]-5-(3-nitrophenyl)-2-furamide Formula: C18H13N3O4S2 MolecularWeight: 399.44352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O4S2/c22-17(20-18(27)19-13-6-1-2-7-16(13)26)15-9-8-14(25-15)11-4-3-5-12(10-11)21(23)24/h1-10,26H,(H2,19,20,22,27)