1-(3-chloranyl-4-fluoranyl-phenyl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[4-[(2-methyl-6-propoxy-4-pyrimidinyl)amino]phenyl]urea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[4-[(2-methyl-6-propoxypyrimidin-4-yl)amino]phenyl]urea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea Formula: C21H21ClFN5O2 MolecularWeight: 429.875143

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C21H21ClFN5O2/c1-3-10-30-20-12-19(24-13(2)25-20)26-14-4-6-15(7-5-14)27-21(29)28-16-8-9-18(23)17(22)11-16/h4-9,11-12H,3,10H2,1-2H3,(H,24,25,26)(H2,27,28,29)