N-[azanyl-[(2-fluorophenyl)amino]methylidene]-2-pyridin-3-yl-prop-2-enamide; methanesulfonate

Systemtic Name: N-[azanyl-[(2-fluorophenyl)amino]methylidene]-2-pyridin-3-yl-prop-2-enamide; methanesulfonate Openeye Name: N-[amino-(2-fluoroanilino)methylene]-2-(3-pyridyl)prop-2-enamide; methanesulfonate CAS Name: N-[amino-(2-fluoroanilino)methylidene]-2-(3-pyridinyl)-2-propenamide; methanesulfonate IUPAC Name: N-[amino-(2-fluoroanilino)methylidene]-2-pyridin-3-ylprop-2-enamide; methanesulfonate Traditional Name: N-[amino-(2-fluoroanilino)methylene]-2-(3-pyridyl)acrylamide mesylate Formula: C16H16FN4O4S- MolecularWeight: 379.386043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C=C(C1=CN=CC=C1)C(=O)N=C(N)NC2=CC=CC=C2F

Isomeric SMILES

CS(=O)(=O)[O-].C=C(C1=CN=CC=C1)C(=O)N=C(N)NC2=CC=CC=C2F

InChI

InChI=1S/C15H13FN4O.CH4O3S/c1-10(11-5-4-8-18-9-11)14(21)20-15(17)19-13-7-3-2-6-12(13)16;1-5(2,3)4/h2-9H,1H2,(H3,17,19,20,21);1H3,(H,2,3,4)/p-1