3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-4-methyl-N-(3-methyl-1,2-oxazol-5-yl)benzamide

Systemtic Name: 3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-4-methyl-N-(3-methyl-1,2-oxazol-5-yl)benzamide Openeye Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-4-methyl-N-(3-methylisoxazol-5-yl)benzamide CAS Name: 3-[2-(2-amino-5-pyrimidinyl)ethynyl]-4-methyl-N-(3-methyl-5-isoxazolyl)benzamide IUPAC Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-4-methyl-N-(3-methyl-1,2-oxazol-5-yl)benzamide Traditional Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-4-methyl-N-(3-methylisoxazol-5-yl)benzamide Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NO2)C)C#CC3=CN=C(N=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NO2)C)C#CC3=CN=C(N=C3)N

InChI

InChI=1S/C18H15N5O2/c1-11-3-5-15(17(24)22-16-7-12(2)23-25-16)8-14(11)6-4-13-9-20-18(19)21-10-13/h3,5,7-10H,1-2H3,(H,22,24)(H2,19,20,21)