4-[(2-azanyl-1,3-thiazol-5-yl)methyl]benzoate

Systemtic Name: 4-[(2-azanyl-1,3-thiazol-5-yl)methyl]benzoate Openeye Name: 4-[(2-aminothiazol-5-yl)methyl]benzoate CAS Name: 4-[(2-amino-5-thiazolyl)methyl]benzoate IUPAC Name: 4-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate Traditional Name: 4-[(2-aminothiazol-5-yl)methyl]benzoate Formula: C11H9N2O2S- MolecularWeight: 233.26636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CN=C(S2)N)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=CN=C(S2)N)C(=O)[O-]

InChI

InChI=1S/C11H10N2O2S/c12-11-13-6-9(16-11)5-7-1-3-8(4-2-7)10(14)15/h1-4,6H,5H2,(H2,12,13)(H,14,15)/p-1