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

Systemtic Name: N-[azanyl-[(3-phenylmethoxyphenyl)amino]methylidene]-2-pyridin-3-yl-prop-2-enamide; methanesulfonate Openeye Name: N-[amino-(3-benzyloxyanilino)methylene]-2-(3-pyridyl)prop-2-enamide; methanesulfonate CAS Name: N-[amino-(3-phenylmethoxyanilino)methylidene]-2-(3-pyridinyl)-2-propenamide; methanesulfonate IUPAC Name: N-[amino-(3-phenylmethoxyanilino)methylidene]-2-pyridin-3-ylprop-2-enamide; methanesulfonate Traditional Name: N-[amino-(3-benzoxyanilino)methylene]-2-(3-pyridyl)acrylamide mesylate Formula: C23H23N4O5S- MolecularWeight: 467.51752

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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=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)[O-].C=C(C1=CN=CC=C1)C(=O)N=C(N)NC2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20N4O2.CH4O3S/c1-16(18-9-6-12-24-14-18)21(27)26-22(23)25-19-10-5-11-20(13-19)28-15-17-7-3-2-4-8-17;1-5(2,3)4/h2-14H,1,15H2,(H3,23,25,26,27);1H3,(H,2,3,4)/p-1