2-[(2-acetamido-1,3-thiazol-5-yl)sulfanyl]benzoic acid

Systemtic Name: 2-[(2-acetamido-1,3-thiazol-5-yl)sulfanyl]benzoic acid Openeye Name: 2-(2-acetamidothiazol-5-yl)sulfanylbenzoic acid CAS Name: 2-[(2-acetamido-5-thiazolyl)thio]benzoic acid IUPAC Name: 2-[(2-acetamido-1,3-thiazol-5-yl)sulfanyl]benzoic acid Traditional Name: 2-[(2-acetamidothiazol-5-yl)thio]benzoic acid Formula: C12H10N2O3S2 MolecularWeight: 294.3494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(S1)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=O)NC1=NC=C(S1)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C12H10N2O3S2/c1-7(15)14-12-13-6-10(19-12)18-9-5-3-2-4-8(9)11(16)17/h2-6H,1H3,(H,16,17)(H,13,14,15)