2-chloranyl-4-[[4-[(3-chloranyl-4-methoxy-phenyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzamide

Systemtic Name: 2-chloranyl-4-[[4-[(3-chloranyl-4-methoxy-phenyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzamide Openeye Name: 2-chloro-4-[[4-(3-chloro-4-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]benzamide CAS Name: 2-chloro-4-[[4-(3-chloro-4-methoxyanilino)-5-fluoro-2-pyrimidinyl]amino]benzamide IUPAC Name: 2-chloro-4-[[4-(3-chloro-4-methoxyanilino)-5-fluoropyrimidin-2-yl]amino]benzamide Traditional Name: 2-chloro-4-[[4-(3-chloro-4-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]benzamide Formula: C18H14Cl2FN5O2 MolecularWeight: 422.240463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)C(=O)N)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)C(=O)N)Cl)Cl

InChI

InChI=1S/C18H14Cl2FN5O2/c1-28-15-5-3-9(7-13(15)20)24-17-14(21)8-23-18(26-17)25-10-2-4-11(16(22)27)12(19)6-10/h2-8H,1H3,(H2,22,27)(H2,23,24,25,26)