(2-acetamido-1,3-thiazol-4-yl)methyl 3-iodanylbenzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-iodanylbenzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 3-iodobenzoate CAS Name: 3-iodobenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-iodobenzoate Traditional Name: 3-iodobenzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C13H11IN2O3S MolecularWeight: 402.20751

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C13H11IN2O3S/c1-8(17)15-13-16-11(7-20-13)6-19-12(18)9-3-2-4-10(14)5-9/h2-5,7H,6H2,1H3,(H,15,16,17)