S-methyl 3-iodanyl-2,6-dimethyl-benzenecarbothioate

Systemtic Name: S-methyl 3-iodanyl-2,6-dimethyl-benzenecarbothioate Openeye Name: S-methyl 3-iodo-2,6-dimethyl-benzenecarbothioate CAS Name: 3-iodo-2,6-dimethylbenzenecarbothioic acid S-methyl ester IUPAC Name: S-methyl 3-iodo-2,6-dimethylbenzenecarbothioate Traditional Name: 3-iodo-2,6-dimethyl-thiobenzoic acid S-methyl ester Formula: C10H11IOS MolecularWeight: 306.16321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)I)C)C(=O)SC

Isomeric SMILES

CC1=C(C(=C(C=C1)I)C)C(=O)SC

InChI

InChI=1S/C10H11IOS/c1-6-4-5-8(11)7(2)9(6)10(12)13-3/h4-5H,1-3H3