4-azanyl-N-cyclobutyl-8-(2,4-dimethoxypyrimidin-5-yl)-7-fluoranyl-cinnoline-3-carboxamide

Systemtic Name: 4-azanyl-N-cyclobutyl-8-(2,4-dimethoxypyrimidin-5-yl)-7-fluoranyl-cinnoline-3-carboxamide Openeye Name: 4-amino-N-cyclobutyl-8-(2,4-dimethoxypyrimidin-5-yl)-7-fluoro-cinnoline-3-carboxamide CAS Name: 4-amino-N-cyclobutyl-8-(2,4-dimethoxy-5-pyrimidinyl)-7-fluoro-3-cinnolinecarboxamide IUPAC Name: 4-amino-N-cyclobutyl-8-(2,4-dimethoxypyrimidin-5-yl)-7-fluorocinnoline-3-carboxamide Traditional Name: 4-amino-N-cyclobutyl-8-(2,4-dimethoxypyrimidin-5-yl)-7-fluoro-cinnoline-3-carboxamide Formula: C19H19FN6O3 MolecularWeight: 398.390963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C2=C(C=CC3=C2N=NC(=C3N)C(=O)NC4CCC4)F)OC

Isomeric SMILES

COC1=NC(=NC=C1C2=C(C=CC3=C2N=NC(=C3N)C(=O)NC4CCC4)F)OC

InChI

InChI=1S/C19H19FN6O3/c1-28-18-11(8-22-19(24-18)29-2)13-12(20)7-6-10-14(21)16(26-25-15(10)13)17(27)23-9-4-3-5-9/h6-9H,3-5H2,1-2H3,(H2,21,25)(H,23,27)