1-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-iodanylphenoxy)ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-iodanylphenoxy)ethanone Openeye Name: 1-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-(4-iodophenoxy)ethanone CAS Name: 1-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-(4-iodophenoxy)ethanone IUPAC Name: 1-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-(4-iodophenoxy)ethanone Traditional Name: 1-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-(4-iodophenoxy)ethanone Formula: C17H15IN2O2S MolecularWeight: 438.28267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)COC3=CC=C(C=C3)I

Isomeric SMILES

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)COC3=CC=C(C=C3)I

InChI

InChI=1S/C17H15IN2O2S/c1-11-9-15(12(2)20(11)17-19-7-8-23-17)16(21)10-22-14-5-3-13(18)4-6-14/h3-9H,10H2,1-2H3