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

Systemtic Name: 2-[4-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[(E)-3-(2-methylthiazol-4-yl)acryloyl]piperazino]acetic acid Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=CC(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=NC(=CS1)/C=C/C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H17N3O3S/c1-10-14-11(9-20-10)2-3-12(17)16-6-4-15(5-7-16)8-13(18)19/h2-3,9H,4-8H2,1H3,(H,18,19)/b3-2+