N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]hexanamide Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C2=CC=C(O2)CO

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C2=CC=C(O2)CO

InChI

InChI=1S/C18H22N2O3S/c1-2-3-4-8-17(22)20-18(24)19-14-7-5-6-13(11-14)16-10-9-15(12-21)23-16/h5-7,9-11,21H,2-4,8,12H2,1H3,(H2,19,20,22,24)