N-(2-oxidanylpropylcarbamothioyl)-4-propan-2-yl-benzamide

Systemtic Name: N-(2-oxidanylpropylcarbamothioyl)-4-propan-2-yl-benzamide Openeye Name: N-(2-hydroxypropylcarbamothioyl)-4-isopropyl-benzamide CAS Name: N-[(2-hydroxypropylamino)-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-(2-hydroxypropylcarbamothioyl)-4-propan-2-ylbenzamide Traditional Name: N-(2-hydroxypropylthiocarbamoyl)-4-isopropyl-benzamide Formula: C14H20N2O2S MolecularWeight: 280.3858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NCC(C)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NCC(C)O

InChI

InChI=1S/C14H20N2O2S/c1-9(2)11-4-6-12(7-5-11)13(18)16-14(19)15-8-10(3)17/h4-7,9-10,17H,8H2,1-3H3,(H2,15,16,18,19)