5-bromanyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[4-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[4-(pyrrolidine-1-carbonyl)phenyl]thiocarbamoyl]-2-furamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O3S/c18-14-8-7-13(24-14)15(22)20-17(25)19-12-5-3-11(4-6-12)16(23)21-9-1-2-10-21/h3-8H,1-2,9-10H2,(H2,19,20,22,25)