4-ethyl-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]benzamide Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO

InChI

InChI=1S/C21H20N2O3S/c1-2-14-6-8-15(9-7-14)20(25)23-21(27)22-17-5-3-4-16(12-17)19-11-10-18(13-24)26-19/h3-12,24H,2,13H2,1H3,(H2,22,23,25,27)