ethyl 5-azanyl-1-[1-(2-phenoxyethyl)pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[1-(2-phenoxyethyl)pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[1-(2-phenoxyethyl)pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[1-(2-phenoxyethyl)-4-pyrazolo[3,4-d]pyrimidinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[1-(2-phenoxyethyl)pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[1-(2-phenoxyethyl)pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H19N7O3 MolecularWeight: 393.39926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC=NC3=C2C=NN3CCOC4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC=NC3=C2C=NN3CCOC4=CC=CC=C4)N

InChI

InChI=1S/C19H19N7O3/c1-2-28-19(27)14-10-24-26(16(14)20)18-15-11-23-25(17(15)21-12-22-18)8-9-29-13-6-4-3-5-7-13/h3-7,10-12H,2,8-9,20H2,1H3