2-fluoranyl-N-(4-oxidanylidene-2-pyridin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide

Systemtic Name: 2-fluoranyl-N-(4-oxidanylidene-2-pyridin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide Openeye Name: 2-fluoro-N-[4-oxo-2-(4-pyridyl)-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl]pyridine-3-carboxamide CAS Name: 2-fluoro-N-(4-oxo-2-pyridin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)-3-pyridinecarboxamide IUPAC Name: 2-fluoro-N-(4-oxo-2-pyridin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide Traditional Name: 2-fluoro-N-[4-keto-2-(4-pyridyl)-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepin-10-yl]nicotinamide Formula: C20H18FN5O2 MolecularWeight: 379.387623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=O)C=C(N=C2C(C1)NC(=O)C3=C(N=CC=C3)F)C4=CC=NC=C4

Isomeric SMILES

C1CCN2C(=O)C=C(N=C2C(C1)NC(=O)C3=C(N=CC=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C20H18FN5O2/c21-18-14(4-3-8-23-18)20(28)25-15-5-1-2-11-26-17(27)12-16(24-19(15)26)13-6-9-22-10-7-13/h3-4,6-10,12,15H,1-2,5,11H2,(H,25,28)