N-(3-cyanophenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(3-cyanophenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(3-cyanophenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(3-cyanophenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(3-cyanophenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C20H14N4OS MolecularWeight: 358.41636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H14N4OS/c21-11-13-4-1-7-15(10-13)22-18(25)12-26-20-23-16-8-2-5-14-6-3-9-17(24-20)19(14)16/h1-10H,12H2,(H,22,25)(H,23,24)