5-ethylsulfanyl-4-iodanyl-3-(4-methylsulfonylphenyl)-1,2-oxazole

Systemtic Name: 5-ethylsulfanyl-4-iodanyl-3-(4-methylsulfonylphenyl)-1,2-oxazole Openeye Name: 5-ethylsulfanyl-4-iodo-3-(4-methylsulfonylphenyl)isoxazole CAS Name: 5-(ethylthio)-4-iodo-3-(4-methylsulfonylphenyl)isoxazole IUPAC Name: 5-ethylsulfanyl-4-iodo-3-(4-methylsulfonylphenyl)-1,2-oxazole Traditional Name: 5-(ethylthio)-4-iodo-3-(4-mesylphenyl)isoxazole Formula: C12H12INO3S2 MolecularWeight: 409.26305

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NO1)C2=CC=C(C=C2)S(=O)(=O)C)I

Isomeric SMILES

CCSC1=C(C(=NO1)C2=CC=C(C=C2)S(=O)(=O)C)I

InChI

InChI=1S/C12H12INO3S2/c1-3-18-12-10(13)11(14-17-12)8-4-6-9(7-5-8)19(2,15)16/h4-7H,3H2,1-2H3