4-[2-azanyl-5-(3-chloranyl-2-fluoranyl-phenyl)pyrimidin-4-yl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-azanyl-5-(3-chloranyl-2-fluoranyl-phenyl)pyrimidin-4-yl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-amino-5-(3-chloro-2-fluoro-phenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide CAS Name: 4-[2-amino-5-(3-chloro-2-fluorophenyl)-4-pyrimidinyl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-amino-5-(3-chloro-2-fluorophenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-amino-5-(3-chloro-2-fluoro-phenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide Formula: C23H19ClFN5O MolecularWeight: 435.881263

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CN2)C3=NC(=NC=C3C4=C(C(=CC=C4)Cl)F)N

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CN2)C3=NC(=NC=C3C4=C(C(=CC=C4)Cl)F)N

InChI

InChI=1S/C23H19ClFN5O/c1-30(13-14-6-3-2-4-7-14)22(31)19-10-15(11-27-19)21-17(12-28-23(26)29-21)16-8-5-9-18(24)20(16)25/h2-12,27H,13H2,1H3,(H2,26,28,29)