5-(2-azanylpyrimidin-4-yl)-2-(5-fluoranyl-2-methyl-phenyl)-1H-pyrrole-3-carboxamide

Systemtic Name: 5-(2-azanylpyrimidin-4-yl)-2-(5-fluoranyl-2-methyl-phenyl)-1H-pyrrole-3-carboxamide Openeye Name: 5-(2-aminopyrimidin-4-yl)-2-(5-fluoro-2-methyl-phenyl)-1H-pyrrole-3-carboxamide CAS Name: 5-(2-amino-4-pyrimidinyl)-2-(5-fluoro-2-methylphenyl)-1H-pyrrole-3-carboxamide IUPAC Name: 5-(2-aminopyrimidin-4-yl)-2-(5-fluoro-2-methylphenyl)-1H-pyrrole-3-carboxamide Traditional Name: 5-(2-aminopyrimidin-4-yl)-2-(5-fluoro-2-methyl-phenyl)-1H-pyrrole-3-carboxamide Formula: C16H14FN5O MolecularWeight: 311.313663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)C2=C(C=C(N2)C3=NC(=NC=C3)N)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)F)C2=C(C=C(N2)C3=NC(=NC=C3)N)C(=O)N

InChI

InChI=1S/C16H14FN5O/c1-8-2-3-9(17)6-10(8)14-11(15(18)23)7-13(21-14)12-4-5-20-16(19)22-12/h2-7,21H,1H3,(H2,18,23)(H2,19,20,22)