5-bromanyl-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]-2-furamide Formula: C17H18BrN3O4S2 MolecularWeight: 472.37652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C17H18BrN3O4S2/c18-15-9-8-14(25-15)16(22)20-17(26)19-12-4-6-13(7-5-12)27(23,24)21-10-2-1-3-11-21/h4-9H,1-3,10-11H2,(H2,19,20,22,26)