(E)-3-(3-fluoranyl-4-methoxy-phenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-3-(3-fluoranyl-4-methoxy-phenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]prop-2-enamide Openeye Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]prop-2-enamide CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-propenamide IUPAC Name: (E)-3-(3-fluoro-4-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]prop-2-enamide Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-N-[6-(3-ketopiperazino)-3-pyridyl]acrylamide Formula: C19H19FN4O3 MolecularWeight: 370.377563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)F

InChI

InChI=1S/C19H19FN4O3/c1-27-16-5-2-13(10-15(16)20)3-7-18(25)23-14-4-6-17(22-11-14)24-9-8-21-19(26)12-24/h2-7,10-11H,8-9,12H2,1H3,(H,21,26)(H,23,25)/b7-3+