2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]ethanenitrile Openeye Name: 2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]acetonitrile CAS Name: 2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]amino]phenyl]acetonitrile IUPAC Name: 2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]acetonitrile Traditional Name: 2-[4-[[4-[(5-cyclohexyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]acetonitrile Formula: C21H23N7 MolecularWeight: 373.45422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC(=NN2)NC3=NC(=NC=C3)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

C1CCC(CC1)C2=CC(=NN2)NC3=NC(=NC=C3)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C21H23N7/c22-12-10-15-6-8-17(9-7-15)24-21-23-13-11-19(26-21)25-20-14-18(27-28-20)16-4-2-1-3-5-16/h6-9,11,13-14,16H,1-5,10H2,(H3,23,24,25,26,27,28)