5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[[4-(1-pyrrolidinylmethyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidinomethyl)phenyl]thiocarbamoyl]-2-furamide Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H22ClN3O2S/c24-18-5-3-4-17(14-18)20-10-11-21(29-20)22(28)26-23(30)25-19-8-6-16(7-9-19)15-27-12-1-2-13-27/h3-11,14H,1-2,12-13,15H2,(H2,25,26,28,30)