2-fluoranyl-6-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-fluoranyl-6-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-fluoro-6-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-fluoro-6-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-fluoro-6-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-fluoro-6-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]amino]benzoic acid Formula: C14H11FN2O3S MolecularWeight: 306.312143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=CC(=O)NC2=C(C(=CC=C2)F)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)/C=C/C(=O)NC2=C(C(=CC=C2)F)C(=O)O

InChI

InChI=1S/C14H11FN2O3S/c1-8-16-9(7-21-8)5-6-12(18)17-11-4-2-3-10(15)13(11)14(19)20/h2-7H,1H3,(H,17,18)(H,19,20)/b6-5+