1-[4-(6-azanylpyrimidin-4-yl)oxyphenyl]-3-[5-tert-butyl-2-(4-phenylmethoxyphenyl)pyrazol-3-yl]urea

Systemtic Name: 1-[4-(6-azanylpyrimidin-4-yl)oxyphenyl]-3-[5-tert-butyl-2-(4-phenylmethoxyphenyl)pyrazol-3-yl]urea Openeye Name: 1-[4-(6-aminopyrimidin-4-yl)oxyphenyl]-3-[2-(4-benzyloxyphenyl)-5-tert-butyl-pyrazol-3-yl]urea CAS Name: 1-[4-[(6-amino-4-pyrimidinyl)oxy]phenyl]-3-[5-tert-butyl-2-(4-phenylmethoxyphenyl)-3-pyrazolyl]urea IUPAC Name: 1-[4-(6-aminopyrimidin-4-yl)oxyphenyl]-3-[5-tert-butyl-2-(4-phenylmethoxyphenyl)pyrazol-3-yl]urea Traditional Name: 1-[4-(6-aminopyrimidin-4-yl)oxyphenyl]-3-[2-(4-benzoxyphenyl)-5-tert-butyl-pyrazol-3-yl]urea Formula: C31H31N7O3 MolecularWeight: 549.62294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)OC3=NC=NC(=C3)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)OC3=NC=NC(=C3)N)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H31N7O3/c1-31(2,3)26-17-28(38(37-26)23-11-15-24(16-12-23)40-19-21-7-5-4-6-8-21)36-30(39)35-22-9-13-25(14-10-22)41-29-18-27(32)33-20-34-29/h4-18,20H,19H2,1-3H3,(H2,32,33,34)(H2,35,36,39)