5-chloranyl-N-(4-chloranyl-2-fluoranyl-phenyl)-2-[(phenylmethyl)amino]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-chloranyl-2-fluoranyl-phenyl)-2-[(phenylmethyl)amino]pyrimidine-4-carboxamide Openeye Name: 2-(benzylamino)-5-chloro-N-(4-chloro-2-fluoro-phenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-chloro-2-fluorophenyl)-2-[(phenylmethyl)amino]-4-pyrimidinecarboxamide IUPAC Name: 2-(benzylamino)-5-chloro-N-(4-chloro-2-fluorophenyl)pyrimidine-4-carboxamide Traditional Name: 2-(benzylamino)-5-chloro-N-(4-chloro-2-fluoro-phenyl)pyrimidine-4-carboxamide Formula: C18H13Cl2FN4O MolecularWeight: 391.226423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=C(C(=N2)C(=O)NC3=C(C=C(C=C3)Cl)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=C(C(=N2)C(=O)NC3=C(C=C(C=C3)Cl)F)Cl

InChI

InChI=1S/C18H13Cl2FN4O/c19-12-6-7-15(14(21)8-12)24-17(26)16-13(20)10-23-18(25-16)22-9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,24,26)(H,22,23,25)