4-[2-[2,4-dimethoxy-5-(2-methyl-1,3-thiazol-4-yl)phenyl]prop-2-enoyl]benzoic acid

Systemtic Name: 4-[2-[2,4-dimethoxy-5-(2-methyl-1,3-thiazol-4-yl)phenyl]prop-2-enoyl]benzoic acid Openeye Name: 4-[2-[2,4-dimethoxy-5-(2-methylthiazol-4-yl)phenyl]prop-2-enoyl]benzoic acid CAS Name: 4-[2-[2,4-dimethoxy-5-(2-methyl-4-thiazolyl)phenyl]-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 4-[2-[2,4-dimethoxy-5-(2-methyl-1,3-thiazol-4-yl)phenyl]prop-2-enoyl]benzoic acid Traditional Name: 4-[2-[2,4-dimethoxy-5-(2-methylthiazol-4-yl)phenyl]acryloyl]benzoic acid Formula: C22H19NO5S MolecularWeight: 409.45496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=C(C=C2OC)OC)C(=C)C(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=C(C=C2OC)OC)C(=C)C(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H19NO5S/c1-12(21(24)14-5-7-15(8-6-14)22(25)26)16-9-17(18-11-29-13(2)23-18)20(28-4)10-19(16)27-3/h5-11H,1H2,2-4H3,(H,25,26)