N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[4-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[4-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: 2,2-dimethyl-N-[[4-(5-methylol-2-furyl)phenyl]thiocarbamoyl]propionamide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3S/c1-17(2,3)15(21)19-16(23)18-12-6-4-11(5-7-12)14-9-8-13(10-20)22-14/h4-9,20H,10H2,1-3H3,(H2,18,19,21,23)