ethyl 2-(2-azanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenyl-propanoate

Systemtic Name: ethyl 2-(2-azanyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenyl-propanoate Openeye Name: ethyl 2-(2-amino-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenyl-propanoate CAS Name: 2-(2-amino-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenylpropanoate Traditional Name: 2-(2-amino-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-phenyl-propionic acid ethyl ester Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)C2=CC=NC3=NC(=NN23)N

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)C2=CC=NC3=NC(=NN23)N

InChI

InChI=1S/C16H17N5O2/c1-2-23-14(22)12(10-11-6-4-3-5-7-11)13-8-9-18-16-19-15(17)20-21(13)16/h3-9,12H,2,10H2,1H3,(H2,17,20)