2-azanyl-3-(5-methyl-1,3-benzothiazol-2-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(5-methyl-1,3-benzothiazol-2-yl)propanoic acid Openeye Name: 2-amino-3-(5-methyl-1,3-benzothiazol-2-yl)propanoic acid CAS Name: 2-amino-3-(5-methyl-1,3-benzothiazol-2-yl)propanoic acid IUPAC Name: 2-amino-3-(5-methyl-1,3-benzothiazol-2-yl)propanoic acid Traditional Name: 2-amino-3-(5-methyl-1,3-benzothiazol-2-yl)propionic acid Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)CC(C(=O)O)N

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)CC(C(=O)O)N

InChI

InChI=1S/C11H12N2O2S/c1-6-2-3-9-8(4-6)13-10(16-9)5-7(12)11(14)15/h2-4,7H,5,12H2,1H3,(H,14,15)