N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-5-hex-1-ynyl-pyridine-3-carboxamide

Systemtic Name: N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-5-hex-1-ynyl-pyridine-3-carboxamide Openeye Name: N-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]-5-hex-1-ynyl-pyridine-3-carboxamide CAS Name: N-[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-pyrazolyl]-5-hex-1-ynyl-3-pyridinecarboxamide IUPAC Name: N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-5-hex-1-ynylpyridine-3-carboxamide Traditional Name: N-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]-5-hex-1-ynyl-nicotinamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)NC2=CN(N=C2)CC3=C(ON=C3C)C

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)NC2=CN(N=C2)CC3=C(ON=C3C)C

InChI

InChI=1S/C21H23N5O2/c1-4-5-6-7-8-17-9-18(11-22-10-17)21(27)24-19-12-23-26(13-19)14-20-15(2)25-28-16(20)3/h9-13H,4-6,14H2,1-3H3,(H,24,27)