N-[4-(cyanomethyl)phenyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C22H16N4OS2 MolecularWeight: 416.51864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCC(=O)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCC(=O)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C22H16N4OS2/c23-11-10-15-6-8-17(9-7-15)26-20(27)13-28-21-18-12-19(16-4-2-1-3-5-16)29-22(18)25-14-24-21/h1-9,12,14H,10,13H2,(H,26,27)