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

Systemtic Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]urea CAS Name: 1-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]urea Traditional Name: 1-benzyl-3-[4-(6-tert-butyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]urea Formula: C24H25N5O MolecularWeight: 399.4882

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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)NCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=NN2)C(=C1)C3=CC=C(C=C3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O/c1-24(2,3)21-13-19(20-15-26-29-22(20)28-21)17-9-11-18(12-10-17)27-23(30)25-14-16-7-5-4-6-8-16/h4-13,15H,14H2,1-3H3,(H2,25,27,30)(H,26,28,29)