4-hexoxy-N-(1-oxidanylbutan-2-ylcarbamothioyl)benzamide

Systemtic Name: 4-hexoxy-N-(1-oxidanylbutan-2-ylcarbamothioyl)benzamide Openeye Name: 4-hexoxy-N-[1-(hydroxymethyl)propylcarbamothioyl]benzamide CAS Name: 4-hexoxy-N-[(1-hydroxybutan-2-ylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-hexoxy-N-(1-hydroxybutan-2-ylcarbamothioyl)benzamide Traditional Name: 4-hexoxy-N-(1-methylolpropylthiocarbamoyl)benzamide Formula: C18H28N2O3S MolecularWeight: 352.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC(CC)CO

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC(CC)CO

InChI

InChI=1S/C18H28N2O3S/c1-3-5-6-7-12-23-16-10-8-14(9-11-16)17(22)20-18(24)19-15(4-2)13-21/h8-11,15,21H,3-7,12-13H2,1-2H3,(H2,19,20,22,24)