ethyl 4-(1-methyl-4-phenylazanyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(1-methyl-4-phenylazanyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(4-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazine-1-carboxylate CAS Name: 4-(4-anilino-1-methyl-6-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-anilino-1-methylpyrazolo[3,4-d]pyrimidin-6-yl)piperazine-1-carboxylate Traditional Name: 4-(4-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazine-1-carboxylic acid ethyl ester Formula: C19H23N7O2 MolecularWeight: 381.43162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=NN3C)C(=N2)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=NN3C)C(=N2)NC4=CC=CC=C4

InChI

InChI=1S/C19H23N7O2/c1-3-28-19(27)26-11-9-25(10-12-26)18-22-16(21-14-7-5-4-6-8-14)15-13-20-24(2)17(15)23-18/h4-8,13H,3,9-12H2,1-2H3,(H,21,22,23)