2-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 2-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 2-phenethyloxy-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 2-phenethyloxy-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 2-phenethyloxy-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C22H21N3O2S MolecularWeight: 391.48604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=CC=CC=C2C(=O)NC(=S)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=CC=CC=C2C(=O)NC(=S)NCC3=CN=CC=C3

InChI

InChI=1S/C22H21N3O2S/c26-21(25-22(28)24-16-18-9-6-13-23-15-18)19-10-4-5-11-20(19)27-14-12-17-7-2-1-3-8-17/h1-11,13,15H,12,14,16H2,(H2,24,25,26,28)