4-[4-[(2-azanylpyrimidin-4-yl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoranyl-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-[4-[(2-azanylpyrimidin-4-yl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoranyl-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[4-[(2-aminopyrimidin-4-yl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[4-[(2-amino-4-pyrimidinyl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoro-5-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[4-[(2-aminopyrimidin-4-yl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-[4-[(2-aminopyrimidin-4-yl)methoxy]-1,2,5-thiadiazol-3-yl]-N-[3-fluoro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C19H18F4N8O2S MolecularWeight: 498.457233

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSN=C2OCC3=NC(=NC=C3)N)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)F

Isomeric SMILES

C1CN(CCN1C2=NSN=C2OCC3=NC(=NC=C3)N)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)F

InChI

InChI=1S/C19H18F4N8O2S/c20-12-7-11(19(21,22)23)8-14(9-12)27-18(32)31-5-3-30(4-6-31)15-16(29-34-28-15)33-10-13-1-2-25-17(24)26-13/h1-2,7-9H,3-6,10H2,(H,27,32)(H2,24,25,26)