1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethyl-urea

Systemtic Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethyl-urea Openeye Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethyl-urea CAS Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethylurea IUPAC Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethylurea Traditional Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-phenethyl-urea Formula: C25H27N5O MolecularWeight: 413.51478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=NN2)C(=C1)C3=CC=C(C=C3)NC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=NN2)C(=C1)C3=CC=C(C=C3)NC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O/c1-25(2,3)22-15-20(21-16-27-30-23(21)29-22)18-9-11-19(12-10-18)28-24(31)26-14-13-17-7-5-4-6-8-17/h4-12,15-16H,13-14H2,1-3H3,(H2,26,28,31)(H,27,29,30)