5-[[5-fluoranyl-4-(2-methyl-3-propan-2-yl-imidazol-4-yl)pyrimidin-2-yl]amino]-2-(4-methylpiperazin-1-yl)carbonyl-benzenecarbonitrile

Systemtic Name: 5-[[5-fluoranyl-4-(2-methyl-3-propan-2-yl-imidazol-4-yl)pyrimidin-2-yl]amino]-2-(4-methylpiperazin-1-yl)carbonyl-benzenecarbonitrile Openeye Name: 5-[[5-fluoro-4-(3-isopropyl-2-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]-2-(4-methylpiperazine-1-carbonyl)benzonitrile CAS Name: 5-[[5-fluoro-4-(2-methyl-3-propan-2-yl-4-imidazolyl)-2-pyrimidinyl]amino]-2-[(4-methyl-1-piperazinyl)-oxomethyl]benzonitrile IUPAC Name: 5-[[5-fluoro-4-(2-methyl-3-propan-2-ylimidazol-4-yl)pyrimidin-2-yl]amino]-2-(4-methylpiperazine-1-carbonyl)benzonitrile Traditional Name: 5-[[5-fluoro-4-(3-isopropyl-2-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]-2-(4-methylpiperazine-1-carbonyl)benzonitrile Formula: C24H27FN8O MolecularWeight: 462.522583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C(C)C)C2=NC(=NC=C2F)NC3=CC(=C(C=C3)C(=O)N4CCN(CC4)C)C#N

Isomeric SMILES

CC1=NC=C(N1C(C)C)C2=NC(=NC=C2F)NC3=CC(=C(C=C3)C(=O)N4CCN(CC4)C)C#N

InChI

InChI=1S/C24H27FN8O/c1-15(2)33-16(3)27-14-21(33)22-20(25)13-28-24(30-22)29-18-5-6-19(17(11-18)12-26)23(34)32-9-7-31(4)8-10-32/h5-6,11,13-15H,7-10H2,1-4H3,(H,28,29,30)