ethyl 5-azanyl-1-[6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[6-(3-methylphenoxy)-4-pyrimidinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)OC3=CC=CC(=C3)C)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)OC3=CC=CC(=C3)C)N

InChI

InChI=1S/C17H17N5O3/c1-3-24-17(23)13-9-21-22(16(13)18)14-8-15(20-10-19-14)25-12-6-4-5-11(2)7-12/h4-10H,3,18H2,1-2H3