sodium 4-(2-acetamido-1,3-thiazol-4-yl)benzenesulfinic acid

Systemtic Name: sodium 4-(2-acetamido-1,3-thiazol-4-yl)benzenesulfinic acid Openeye Name: sodium 4-(2-acetamidothiazol-4-yl)benzenesulfinic acid CAS Name: sodium 4-(2-acetamido-4-thiazolyl)benzenesulfinic acid IUPAC Name: sodium 4-(2-acetamido-1,3-thiazol-4-yl)benzenesulfinic acid Traditional Name: sodium 4-(2-acetamidothiazol-4-yl)benzenesulfinic acid Formula: C11H10N2NaO3S2+ MolecularWeight: 305.32847

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)S(=O)O.[Na+]

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)S(=O)O.[Na+]

InChI

InChI=1S/C11H10N2O3S2.Na/c1-7(14)12-11-13-10(6-17-11)8-2-4-9(5-3-8)18(15)16;/h2-6H,1H3,(H,15,16)(H,12,13,14);/q;+1