5-cyano-N-cyclopropyl-4-(2-fluoranyl-3-pyridin-3-yl-phenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxamide

Systemtic Name: 5-cyano-N-cyclopropyl-4-(2-fluoranyl-3-pyridin-3-yl-phenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxamide Openeye Name: 5-cyano-N-cyclopropyl-4-[2-fluoro-3-(3-pyridyl)phenyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxamide CAS Name: 5-cyano-N-cyclopropyl-4-[2-fluoro-3-(3-pyridinyl)phenyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxamide IUPAC Name: 5-cyano-N-cyclopropyl-4-(2-fluoro-3-pyridin-3-ylphenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxamide Traditional Name: 5-cyano-N-cyclopropyl-4-[2-fluoro-3-(3-pyridyl)phenyl]-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxamide Formula: C21H18FN5O2 MolecularWeight: 391.398323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)NC2CC2)C3=CC=CC(=C3F)C4=CN=CC=C4)C#N

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)NC2CC2)C3=CC=CC(=C3F)C4=CN=CC=C4)C#N

InChI

InChI=1S/C21H18FN5O2/c1-12-17(10-23)19(27(20(28)25-12)21(29)26-14-7-8-14)16-6-2-5-15(18(16)22)13-4-3-9-24-11-13/h2-6,9,11,14,19H,7-8H2,1H3,(H,25,28)(H,26,29)