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

Systemtic Name: N-[azanyl-[(3-methoxyphenyl)amino]methylidene]-2-thiophen-3-yl-prop-2-enamide; methanesulfonate Openeye Name: N-[amino-(3-methoxyanilino)methylene]-2-(3-thienyl)prop-2-enamide; methanesulfonate CAS Name: N-[amino-(3-methoxyanilino)methylidene]-2-(3-thiophenyl)-2-propenamide; methanesulfonate IUPAC Name: N-[amino-(3-methoxyanilino)methylidene]-2-thiophen-3-ylprop-2-enamide; methanesulfonate Traditional Name: N-[amino(m-anisidino)methylene]-2-(3-thienyl)acrylamide mesylate Formula: C16H18N3O5S2- MolecularWeight: 396.46122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=NC(=O)C(=C)C2=CSC=C2)N.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC(=NC(=O)C(=C)C2=CSC=C2)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C15H15N3O2S.CH4O3S/c1-10(11-6-7-21-9-11)14(19)18-15(16)17-12-4-3-5-13(8-12)20-2;1-5(2,3)4/h3-9H,1H2,2H3,(H3,16,17,18,19);1H3,(H,2,3,4)/p-1