2-[2-(heptanoylamino)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(heptanoylamino)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(heptanoylamino)thiazol-4-yl]acetic acid CAS Name: 2-[2-(1-oxoheptylamino)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(heptanoylamino)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(enanthylamino)thiazol-4-yl]acetic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=NC(=CS1)CC(=O)O

Isomeric SMILES

CCCCCCC(=O)NC1=NC(=CS1)CC(=O)O

InChI

InChI=1S/C12H18N2O3S/c1-2-3-4-5-6-10(15)14-12-13-9(8-18-12)7-11(16)17/h8H,2-7H2,1H3,(H,16,17)(H,13,14,15)