N-(2-oxidanylpropylcarbamothioyl)-4-phenyl-benzamide

Systemtic Name: N-(2-oxidanylpropylcarbamothioyl)-4-phenyl-benzamide Openeye Name: N-(2-hydroxypropylcarbamothioyl)-4-phenyl-benzamide CAS Name: N-[(2-hydroxypropylamino)-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-(2-hydroxypropylcarbamothioyl)-4-phenylbenzamide Traditional Name: N-(2-hydroxypropylthiocarbamoyl)-4-phenyl-benzamide Formula: C17H18N2O2S MolecularWeight: 314.40202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=S)NC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)O

Isomeric SMILES

CC(CNC(=S)NC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C17H18N2O2S/c1-12(20)11-18-17(22)19-16(21)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12,20H,11H2,1H3,(H2,18,19,21,22)