3-iodanyl-4-methyl-N-(oxolan-2-ylmethylcarbamothioyl)benzamide

Systemtic Name: 3-iodanyl-4-methyl-N-(oxolan-2-ylmethylcarbamothioyl)benzamide Openeye Name: 3-iodo-4-methyl-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)benzamide CAS Name: 3-iodo-4-methyl-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methyl-N-(oxolan-2-ylmethylcarbamothioyl)benzamide Traditional Name: 3-iodo-4-methyl-N-(tetrahydrofurfurylthiocarbamoyl)benzamide Formula: C14H17IN2O2S MolecularWeight: 404.26645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2CCCO2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2CCCO2)I

InChI

InChI=1S/C14H17IN2O2S/c1-9-4-5-10(7-12(9)15)13(18)17-14(20)16-8-11-3-2-6-19-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,16,17,18,20)