N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide CAS Name: N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-4-pyrazolo[3,4-d]pyrimidinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methylpyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Formula: C26H35N7O2 MolecularWeight: 477.6018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)C3CC3)N4CCCN(CC4)C(=O)NC(C)(C)C)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)C3CC3)N4CCCN(CC4)C(=O)NC(C)(C)C)C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H35N7O2/c1-17-21-23(31-13-6-14-32(16-15-31)25(34)29-26(2,3)4)27-22(18-7-8-18)28-24(21)33(30-17)19-9-11-20(35-5)12-10-19/h9-12,18H,6-8,13-16H2,1-5H3,(H,29,34)