2-(4-methoxyphenyl)-N-(pyridin-3-ylmethylcarbamothioyl)ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-(pyridin-3-ylmethylcarbamothioyl)ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-(3-pyridylmethylcarbamothioyl)acetamide CAS Name: 2-(4-methoxyphenyl)-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-(pyridin-3-ylmethylcarbamothioyl)acetamide Traditional Name: 2-(4-methoxyphenyl)-N-(3-pyridylmethylthiocarbamoyl)acetamide Formula: C16H17N3O2S MolecularWeight: 315.39008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC(=S)NCC2=CN=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C16H17N3O2S/c1-21-14-6-4-12(5-7-14)9-15(20)19-16(22)18-11-13-3-2-8-17-10-13/h2-8,10H,9,11H2,1H3,(H2,18,19,20,22)