N-[(3-cyanophenyl)carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[(3-cyanophenyl)carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[(3-cyanophenyl)carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[(3-cyanoanilino)-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[(3-cyanophenyl)carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[(3-cyanophenyl)thiocarbamoyl]benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C20H21N3O2S/c1-2-3-6-12-25-18-11-5-4-10-17(18)19(24)23-20(26)22-16-9-7-8-15(13-16)14-21/h4-5,7-11,13H,2-3,6,12H2,1H3,(H2,22,23,24,26)