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

Systemtic Name: 2-[2-[3-(3-bromophenyl)propanoylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[3-(3-bromophenyl)propanoylamino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[3-(3-bromophenyl)-1-oxopropyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[3-(3-bromophenyl)propanoylamino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[3-(3-bromophenyl)propanoylamino]thiazol-4-yl]acetic acid Formula: C14H13BrN2O3S MolecularWeight: 369.23362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CCC(=O)NC2=NC(=CS2)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CCC(=O)NC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C14H13BrN2O3S/c15-10-3-1-2-9(6-10)4-5-12(18)17-14-16-11(8-21-14)7-13(19)20/h1-3,6,8H,4-5,7H2,(H,19,20)(H,16,17,18)