5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-carboxamide

Systemtic Name: 5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-carboxamide Openeye Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-(5-tert-butylisoxazol-3-yl)thiophene-2-carboxamide CAS Name: 5-[2-(2-amino-5-pyrimidinyl)ethynyl]-N-(5-tert-butyl-3-isoxazolyl)-2-thiophenecarboxamide IUPAC Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-carboxamide Traditional Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-(5-tert-butylisoxazol-3-yl)thiophene-2-carboxamide Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=O)C2=CC=C(S2)C#CC3=CN=C(N=C3)N

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)C2=CC=C(S2)C#CC3=CN=C(N=C3)N

InChI

InChI=1S/C18H17N5O2S/c1-18(2,3)14-8-15(23-25-14)22-16(24)13-7-6-12(26-13)5-4-11-9-20-17(19)21-10-11/h6-10H,1-3H3,(H2,19,20,21)(H,22,23,24)