2-(5-fluoranyl-4-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyphenyl)ethanamide

Systemtic Name: 2-(5-fluoranyl-4-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyphenyl)ethanamide Openeye Name: 2-(5-fluoro-4-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-N-(2-hydroxyphenyl)acetamide CAS Name: 2-[[5-fluoro-4-(1-pyrrolidinyl)-2-pyrimidinyl]thio]-N-(2-hydroxyphenyl)acetamide IUPAC Name: 2-(5-fluoro-4-pyrrolidin-1-ylpyrimidin-2-yl)sulfanyl-N-(2-hydroxyphenyl)acetamide Traditional Name: 2-[(5-fluoro-4-pyrrolidino-pyrimidin-2-yl)thio]-N-(2-hydroxyphenyl)acetamide Formula: C16H17FN4O2S MolecularWeight: 348.395183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC=C2F)SCC(=O)NC3=CC=CC=C3O

Isomeric SMILES

C1CCN(C1)C2=NC(=NC=C2F)SCC(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C16H17FN4O2S/c17-11-9-18-16(20-15(11)21-7-3-4-8-21)24-10-14(23)19-12-5-1-2-6-13(12)22/h1-2,5-6,9,22H,3-4,7-8,10H2,(H,19,23)