5-(3,4-dichlorophenyl)-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3,4-dichlorophenyl)-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dichlorophenyl)-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dichlorophenyl)-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dichlorophenyl)-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dichlorophenyl)-N-[(4-pyrrolidinophenyl)thiocarbamoyl]-2-furamide Formula: C22H19Cl2N3O2S MolecularWeight: 460.37616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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