5-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(2-nitrophenyl)-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(2-nitrophenyl)-N-[(2-pyrrolidinophenyl)thiocarbamoyl]-2-furamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S/c27-21(20-12-11-19(30-20)15-7-1-3-9-17(15)26(28)29)24-22(31)23-16-8-2-4-10-18(16)25-13-5-6-14-25/h1-4,7-12H,5-6,13-14H2,(H2,23,24,27,31)