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

Systemtic Name: N-cyclopropyl-3-methyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Openeye Name: N-cyclopropyl-3-methyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide CAS Name: N-cyclopropyl-3-methyl-4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]benzamide IUPAC Name: N-cyclopropyl-3-methyl-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Traditional Name: N-cyclopropyl-3-methyl-4-[(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(=C1)C(=O)NC2CC2)NC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CC2)NC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

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