(E)-3-(4-chlorophenyl)-N-(2-oxidanylpropylcarbamothioyl)prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-N-(2-oxidanylpropylcarbamothioyl)prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-(2-hydroxypropylcarbamothioyl)prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[(2-hydroxypropylamino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-(2-hydroxypropylcarbamothioyl)prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-(2-hydroxypropylthiocarbamoyl)acrylamide Formula: C13H15ClN2O2S MolecularWeight: 298.7884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=S)NC(=O)C=CC1=CC=C(C=C1)Cl)O

Isomeric SMILES

CC(CNC(=S)NC(=O)/C=C/C1=CC=C(C=C1)Cl)O

InChI

InChI=1S/C13H15ClN2O2S/c1-9(17)8-15-13(19)16-12(18)7-4-10-2-5-11(14)6-3-10/h2-7,9,17H,8H2,1H3,(H2,15,16,18,19)/b7-4+