N-cyclopropyl-2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide

Systemtic Name: N-cyclopropyl-2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Openeye Name: N-cyclopropyl-2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide CAS Name: N-cyclopropyl-2-methyl-3-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]benzamide IUPAC Name: N-cyclopropyl-2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Traditional Name: N-cyclopropyl-2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)NC5CC5

Isomeric SMILES

CC1=C(C=CC=C1NC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)NC5CC5

InChI

InChI=1S/C22H20N6O/c1-14-17(22(29)26-15-10-11-15)8-5-9-19(14)27-20-18-12-25-28(21(18)24-13-23-20)16-6-3-2-4-7-16/h2-9,12-13,15H,10-11H2,1H3,(H,26,29)(H,23,24,27)