2-[3-[3-tert-butyl-5-[[4-methyl-3-(pyrimidin-2-ylamino)phenyl]carbamoylamino]pyrazol-1-yl]phenyl]ethanamide

Systemtic Name: 2-[3-[3-tert-butyl-5-[[4-methyl-3-(pyrimidin-2-ylamino)phenyl]carbamoylamino]pyrazol-1-yl]phenyl]ethanamide Openeye Name: 2-[3-[3-tert-butyl-5-[[4-methyl-3-(pyrimidin-2-ylamino)phenyl]carbamoylamino]pyrazol-1-yl]phenyl]acetamide CAS Name: 2-[3-[3-tert-butyl-5-[[[4-methyl-3-(2-pyrimidinylamino)anilino]-oxomethyl]amino]-1-pyrazolyl]phenyl]acetamide IUPAC Name: 2-[3-[3-tert-butyl-5-[[4-methyl-3-(pyrimidin-2-ylamino)phenyl]carbamoylamino]pyrazol-1-yl]phenyl]acetamide Traditional Name: 2-[3-[3-tert-butyl-5-[[4-methyl-3-(2-pyrimidylamino)phenyl]carbamoylamino]pyrazol-1-yl]phenyl]acetamide Formula: C27H30N8O2 MolecularWeight: 498.5795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=NN2C3=CC=CC(=C3)CC(=O)N)C(C)(C)C)NC4=NC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=NN2C3=CC=CC(=C3)CC(=O)N)C(C)(C)C)NC4=NC=CC=N4

InChI

InChI=1S/C27H30N8O2/c1-17-9-10-19(15-21(17)32-25-29-11-6-12-30-25)31-26(37)33-24-16-22(27(2,3)4)34-35(24)20-8-5-7-18(13-20)14-23(28)36/h5-13,15-16H,14H2,1-4H3,(H2,28,36)(H,29,30,32)(H2,31,33,37)