N-[4-[(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]-N-(2-fluorophenyl)ethanamide

Systemtic Name: N-[4-[(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]-N-(2-fluorophenyl)ethanamide Openeye Name: N-[4-[(4-amino-5-cyano-pyrimidin-2-yl)sulfanylmethyl]thiazol-2-yl]-N-(2-fluorophenyl)acetamide CAS Name: N-[4-[[(4-amino-5-cyano-2-pyrimidinyl)thio]methyl]-2-thiazolyl]-N-(2-fluorophenyl)acetamide IUPAC Name: N-[4-[(4-amino-5-cyanopyrimidin-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]-N-(2-fluorophenyl)acetamide Traditional Name: N-[4-[[(4-amino-5-cyano-pyrimidin-2-yl)thio]methyl]thiazol-2-yl]-N-(2-fluorophenyl)acetamide Formula: C17H13FN6OS2 MolecularWeight: 400.453123

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C17H13FN6OS2/c1-10(25)24(14-5-3-2-4-13(14)18)17-22-12(9-27-17)8-26-16-21-7-11(6-19)15(20)23-16/h2-5,7,9H,8H2,1H3,(H2,20,21,23)