(E)-2-cyano-3-[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]prop-2-enoate

Systemtic Name: (E)-2-cyano-3-[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]prop-2-enoate Openeye Name: (E)-3-[2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-(N-acetyl-2,6-dimethylanilino)-4-thiazolyl]-2-cyano-2-propenoate IUPAC Name: (E)-3-[2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]-2-cyano-acrylate Formula: C17H14N3O3S- MolecularWeight: 340.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)C=C(C#N)C(=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)/C=C(\C#N)/C(=O)[O-])C(=O)C

InChI

InChI=1S/C17H15N3O3S/c1-10-5-4-6-11(2)15(10)20(12(3)21)17-19-14(9-24-17)7-13(8-18)16(22)23/h4-7,9H,1-3H3,(H,22,23)/p-1/b13-7+