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

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[4-(pyrrolidinomethyl)phenyl]thiocarbamoyl]-2-furamide Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CO3

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CO3

InChI

InChI=1S/C17H19N3O2S/c21-16(15-4-3-11-22-15)19-17(23)18-14-7-5-13(6-8-14)12-20-9-1-2-10-20/h3-8,11H,1-2,9-10,12H2,(H2,18,19,21,23)