6-ethylsulfonyl-8-fluoranyl-4-[(5-fluoranylpyridin-3-yl)amino]cinnoline-3-carboxamide

Systemtic Name: 6-ethylsulfonyl-8-fluoranyl-4-[(5-fluoranylpyridin-3-yl)amino]cinnoline-3-carboxamide Openeye Name: 6-ethylsulfonyl-8-fluoro-4-[(5-fluoro-3-pyridyl)amino]cinnoline-3-carboxamide CAS Name: 6-ethylsulfonyl-8-fluoro-4-[(5-fluoro-3-pyridinyl)amino]-3-cinnolinecarboxamide IUPAC Name: 6-ethylsulfonyl-8-fluoro-4-[(5-fluoropyridin-3-yl)amino]cinnoline-3-carboxamide Traditional Name: 6-esyl-8-fluoro-4-[(5-fluoro-3-pyridyl)amino]cinnoline-3-carboxamide Formula: C16H13F2N5O3S MolecularWeight: 393.367926

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C2C(=C1)C(=C(N=N2)C(=O)N)NC3=CC(=CN=C3)F)F

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C2C(=C1)C(=C(N=N2)C(=O)N)NC3=CC(=CN=C3)F)F

InChI

InChI=1S/C16H13F2N5O3S/c1-2-27(25,26)10-4-11-13(12(18)5-10)22-23-15(16(19)24)14(11)21-9-3-8(17)6-20-7-9/h3-7H,2H2,1H3,(H2,19,24)(H,21,22)