[4-[(E)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-iodanyl-phenyl] ethanoate

Systemtic Name: [4-[(E)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-iodanyl-phenyl] ethanoate Openeye Name: [4-[(E)-(2-acetamido-4-oxo-thiazol-5-ylidene)methyl]-2-iodo-phenyl] acetate CAS Name: acetic acid [4-[(E)-(2-acetamido-4-oxo-5-thiazolylidene)methyl]-2-iodophenyl] ester IUPAC Name: [4-[(E)-(2-acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-iodophenyl] acetate Traditional Name: acetic acid [4-[(E)-(2-acetamido-4-keto-2-thiazolin-5-ylidene)methyl]-2-iodo-phenyl] ester Formula: C14H11IN2O4S MolecularWeight: 430.21761

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C)I)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)/C(=C\C2=CC(=C(C=C2)OC(=O)C)I)/S1

InChI

InChI=1S/C14H11IN2O4S/c1-7(18)16-14-17-13(20)12(22-14)6-9-3-4-11(10(15)5-9)21-8(2)19/h3-6H,1-2H3,(H,16,17,18,20)/b12-6+