2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide Formula: C17H16F3N5O3S MolecularWeight: 427.40085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C17H16F3N5O3S/c1-27-4-5-28-13-3-2-11(17(18,19)20)6-12(13)24-14(26)9-29-16-23-8-10(7-21)15(22)25-16/h2-3,6,8H,4-5,9H2,1H3,(H,24,26)(H2,22,23,25)