N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C17H13FN4OS2 MolecularWeight: 372.439723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(CCC#N)C(=O)CSC2=NC=NC3=C2C=CS3)F

Isomeric SMILES

C1=CC(=CC=C1N(CCC#N)C(=O)CSC2=NC=NC3=C2C=CS3)F

InChI

InChI=1S/C17H13FN4OS2/c18-12-2-4-13(5-3-12)22(8-1-7-19)15(23)10-25-17-14-6-9-24-16(14)20-11-21-17/h2-6,9,11H,1,8,10H2