N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]hexanamide

Systemtic Name: N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]hexanamide Openeye Name: N-[[[1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carbonyl]amino]carbamothioyl]hexanamide CAS Name: N-[[[[1-(2-furanylmethyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[[1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl]amino]carbamothioyl]hexanamide Traditional Name: N-[[[1-(2-furfuryl)-5-keto-pyrrolidine-3-carbonyl]amino]thiocarbamoyl]hexanamide Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NNC(=O)C1CC(=O)N(C1)CC2=CC=CO2

Isomeric SMILES

CCCCCC(=O)NC(=S)NNC(=O)C1CC(=O)N(C1)CC2=CC=CO2

InChI

InChI=1S/C17H24N4O4S/c1-2-3-4-7-14(22)18-17(26)20-19-16(24)12-9-15(23)21(10-12)11-13-6-5-8-25-13/h5-6,8,12H,2-4,7,9-11H2,1H3,(H,19,24)(H2,18,20,22,26)