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

Systemtic Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]butanamide Openeye Name: N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]butanamide CAS Name: N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]butanamide Traditional Name: N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]butyramide Formula: C16H18N2O3S MolecularWeight: 318.39072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3S/c1-2-4-15(20)18-16(22)17-12-6-3-5-11(9-12)14-8-7-13(10-19)21-14/h3,5-9,19H,2,4,10H2,1H3,(H2,17,18,20,22)