1-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea

Systemtic Name: 1-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea Openeye Name: 1-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea CAS Name: 1-(5-tert-butyl-2-phenyl-3-pyrazolyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea IUPAC Name: 1-(5-tert-butyl-2-phenylpyrazol-3-yl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea Traditional Name: 1-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)phenyl]urea Formula: C26H26N8O MolecularWeight: 466.53764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC=NC4=C3C=CN4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC=NC4=C3C=CN4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N8O/c1-26(2,3)21-15-22(34(33-21)19-7-5-4-6-8-19)32-25(35)31-18-11-9-17(10-12-18)30-24-20-13-14-27-23(20)28-16-29-24/h4-16H,1-3H3,(H2,31,32,35)(H2,27,28,29,30)