N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-5-(3-chlorophenyl)furan-2-carboxamide

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-5-(3-chlorophenyl)furan-2-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]-2-furamide Formula: C22H19Cl2N3O2S MolecularWeight: 460.37616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H19Cl2N3O2S/c23-15-6-3-5-14(13-15)18-9-10-19(29-18)21(28)26-22(30)25-17-8-4-7-16(24)20(17)27-11-1-2-12-27/h3-10,13H,1-2,11-12H2,(H2,25,26,28,30)