1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyrazolo[3,4-d]pyrimidin-1-ylnaphthalen-1-yl)urea

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyrazolo[3,4-d]pyrimidin-1-ylnaphthalen-1-yl)urea Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyrazolo[3,4-d]pyrimidin-1-yl-1-naphthyl)urea CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-(1-pyrazolo[3,4-d]pyrimidinyl)-1-naphthalenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-(4-pyrazolo[3,4-d]pyrimidin-1-ylnaphthalen-1-yl)urea Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(4-pyrazolo[3,4-d]pyrimidin-1-yl-1-naphthyl)urea Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)N4C5=NC=NC=C5C=N4

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)N4C5=NC=NC=C5C=N4

InChI

InChI=1S/C27H26N6O2/c1-27(2,3)18-9-12-24(35-4)22(13-18)32-26(34)31-21-10-11-23(20-8-6-5-7-19(20)21)33-25-17(15-30-33)14-28-16-29-25/h5-16H,1-4H3,(H2,31,32,34)