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

Systemtic Name: 3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]amino]butyric acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-7(5-11(15)16)12-10(14)4-3-9-6-17-8(2)13-9/h3-4,6-7H,5H2,1-2H3,(H,12,14)(H,15,16)/b4-3+