S-methyl 5-chloranyl-3-(4,5-dihydro-1,2-oxazol-3-yl)-2,4-dimethyl-benzenecarbothioate

Systemtic Name: S-methyl 5-chloranyl-3-(4,5-dihydro-1,2-oxazol-3-yl)-2,4-dimethyl-benzenecarbothioate Openeye Name: S-methyl 5-chloro-3-(4,5-dihydroisoxazol-3-yl)-2,4-dimethyl-benzenecarbothioate CAS Name: 5-chloro-3-(4,5-dihydroisoxazol-3-yl)-2,4-dimethylbenzenecarbothioic acid S-methyl ester IUPAC Name: S-methyl 5-chloro-3-(4,5-dihydro-1,2-oxazol-3-yl)-2,4-dimethylbenzenecarbothioate Traditional Name: 5-chloro-3-(2-isoxazolin-3-yl)-2,4-dimethyl-thiobenzoic acid S-methyl ester Formula: C13H14ClNO2S MolecularWeight: 283.77376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)SC)Cl)C)C2=NOCC2

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)SC)Cl)C)C2=NOCC2

InChI

InChI=1S/C13H14ClNO2S/c1-7-9(13(16)18-3)6-10(14)8(2)12(7)11-4-5-17-15-11/h6H,4-5H2,1-3H3