1-(2-ethylphenyl)-3-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea

Systemtic Name: 1-(2-ethylphenyl)-3-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea Openeye Name: 1-(2-ethylphenyl)-3-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea CAS Name: 1-(2-ethylphenyl)-3-[4-[[6-(1-pyrazolyl)-4-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(2-ethylphenyl)-3-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea Traditional Name: 1-(2-ethylphenyl)-3-[4-[(6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea Formula: C22H21N7O MolecularWeight: 399.44844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)N4C=CC=N4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)N4C=CC=N4

InChI

InChI=1S/C22H21N7O/c1-2-16-6-3-4-7-19(16)28-22(30)27-18-10-8-17(9-11-18)26-20-14-21(24-15-23-20)29-13-5-12-25-29/h3-15H,2H2,1H3,(H,23,24,26)(H2,27,28,30)