ethyl 2-(5-azanyl-1-tert-butyl-4-cyano-pyrazol-3-yl)-2-pyridin-4-yl-ethanoate

Systemtic Name: ethyl 2-(5-azanyl-1-tert-butyl-4-cyano-pyrazol-3-yl)-2-pyridin-4-yl-ethanoate Openeye Name: ethyl 2-(5-amino-1-tert-butyl-4-cyano-pyrazol-3-yl)-2-(4-pyridyl)acetate CAS Name: 2-(5-amino-1-tert-butyl-4-cyano-3-pyrazolyl)-2-pyridin-4-ylacetic acid ethyl ester IUPAC Name: ethyl 2-(5-amino-1-tert-butyl-4-cyanopyrazol-3-yl)-2-pyridin-4-ylacetate Traditional Name: 2-(5-amino-1-tert-butyl-4-cyano-pyrazol-3-yl)-2-(4-pyridyl)acetic acid ethyl ester Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=NC=C1)C2=NN(C(=C2C#N)N)C(C)(C)C

Isomeric SMILES

CCOC(=O)C(C1=CC=NC=C1)C2=NN(C(=C2C#N)N)C(C)(C)C

InChI

InChI=1S/C17H21N5O2/c1-5-24-16(23)13(11-6-8-20-9-7-11)14-12(10-18)15(19)22(21-14)17(2,3)4/h6-9,13H,5,19H2,1-4H3