5-[3-oxidanyl-3-(1,3-thiazol-2-yl)but-1-ynyl]-N-pyrimidin-4-yl-pyridine-3-carboxamide

Systemtic Name: 5-[3-oxidanyl-3-(1,3-thiazol-2-yl)but-1-ynyl]-N-pyrimidin-4-yl-pyridine-3-carboxamide Openeye Name: 5-(3-hydroxy-3-thiazol-2-yl-but-1-ynyl)-N-pyrimidin-4-yl-pyridine-3-carboxamide CAS Name: 5-[3-hydroxy-3-(2-thiazolyl)but-1-ynyl]-N-(4-pyrimidinyl)-3-pyridinecarboxamide IUPAC Name: 5-[3-hydroxy-3-(1,3-thiazol-2-yl)but-1-ynyl]-N-pyrimidin-4-ylpyridine-3-carboxamide Traditional Name: 5-(3-hydroxy-3-thiazol-2-yl-but-1-ynyl)-N-(4-pyrimidyl)nicotinamide Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CN=C1)C(=O)NC2=NC=NC=C2)(C3=NC=CS3)O

Isomeric SMILES

CC(C#CC1=CC(=CN=C1)C(=O)NC2=NC=NC=C2)(C3=NC=CS3)O

InChI

InChI=1S/C17H13N5O2S/c1-17(24,16-20-6-7-25-16)4-2-12-8-13(10-19-9-12)15(23)22-14-3-5-18-11-21-14/h3,5-11,24H,1H3,(H,18,21,22,23)