methyl 5-azanyl-1-[6-(3,5-dimethylphenoxy)pyrimidin-4-yl]pyrazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2)N3C(=C(C=N3)C(=O)OC)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2)N3C(=C(C=N3)C(=O)OC)N)C

InChI

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