2-[[ethenyl-[4-propan-2-yl-2-(1,3-thiazol-2-yl)phenyl]amino]methylidene]propanedioic acid

Systemtic Name: 2-[[ethenyl-[4-propan-2-yl-2-(1,3-thiazol-2-yl)phenyl]amino]methylidene]propanedioic acid Openeye Name: 2-[(4-isopropyl-2-thiazol-2-yl-N-vinyl-anilino)methylene]propanedioic acid CAS Name: 2-[[N-ethenyl-4-propan-2-yl-2-(2-thiazolyl)anilino]methylidene]propanedioic acid IUPAC Name: 2-[[N-ethenyl-4-propan-2-yl-2-(1,3-thiazol-2-yl)anilino]methylidene]propanedioic acid Traditional Name: 2-[(4-isopropyl-2-thiazol-2-yl-N-vinyl-anilino)methylene]malonic acid Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)N(C=C)C=C(C(=O)O)C(=O)O)C2=NC=CS2

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)N(C=C)C=C(C(=O)O)C(=O)O)C2=NC=CS2

InChI

InChI=1S/C18H18N2O4S/c1-4-20(10-14(17(21)22)18(23)24)15-6-5-12(11(2)3)9-13(15)16-19-7-8-25-16/h4-11H,1H2,2-3H3,(H,21,22)(H,23,24)