S-octyl 4-methylbenzenecarbothioate

Systemtic Name: S-octyl 4-methylbenzenecarbothioate Openeye Name: S-octyl 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-octyl ester IUPAC Name: S-octyl 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-octyl ester Formula: C16H24OS MolecularWeight: 264.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCSC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H24OS/c1-3-4-5-6-7-8-13-18-16(17)15-11-9-14(2)10-12-15/h9-12H,3-8,13H2,1-2H3