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

Systemtic Name: 5-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]amino]benzoic acid Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O4S/c1-8-15-10(7-21-8)3-5-13(18)16-9-2-4-12(17)11(6-9)14(19)20/h2-7,17H,1H3,(H,16,18)(H,19,20)/b5-3+