methyl 3-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]propanoate hydrobromide

Systemtic Name: methyl 3-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]propanoate hydrobromide Openeye Name: methyl 3-[4-(2-aminothiazol-4-yl)phenyl]propanoate hydrobromide CAS Name: 3-[4-(2-amino-4-thiazolyl)phenyl]propanoic acid methyl ester hydrobromide IUPAC Name: methyl 3-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propanoate hydrobromide Traditional Name: 3-[4-(2-aminothiazol-4-yl)phenyl]propionic acid methyl ester hydrobromide Formula: C13H15BrN2O2S MolecularWeight: 343.2394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2=CSC(=N2)N.Br

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2=CSC(=N2)N.Br

InChI

InChI=1S/C13H14N2O2S.BrH/c1-17-12(16)7-4-9-2-5-10(6-3-9)11-8-18-13(14)15-11;/h2-3,5-6,8H,4,7H2,1H3,(H2,14,15);1H