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

Systemtic Name: N-[azanyl-[(2-methoxyphenyl)amino]methylidene]-2-pyridin-3-yl-prop-2-enamide; methanesulfonate Openeye Name: N-[amino-(2-methoxyanilino)methylene]-2-(3-pyridyl)prop-2-enamide; methanesulfonate CAS Name: N-[amino-(2-methoxyanilino)methylidene]-2-(3-pyridinyl)-2-propenamide; methanesulfonate IUPAC Name: N-[amino-(2-methoxyanilino)methylidene]-2-pyridin-3-ylprop-2-enamide; methanesulfonate Traditional Name: N-[amino(o-anisidino)methylene]-2-(3-pyridyl)acrylamide mesylate Formula: C17H19N4O5S- MolecularWeight: 391.42156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=NC(=O)C(=C)C2=CN=CC=C2)N.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=NC(=O)C(=C)C2=CN=CC=C2)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C16H16N4O2.CH4O3S/c1-11(12-6-5-9-18-10-12)15(21)20-16(17)19-13-7-3-4-8-14(13)22-2;1-5(2,3)4/h3-10H,1H2,2H3,(H3,17,19,20,21);1H3,(H,2,3,4)/p-1