S-(3-methylbutyl) benzenecarbothioate

Systemtic Name: S-(3-methylbutyl) benzenecarbothioate Openeye Name: S-isopentyl benzenecarbothioate CAS Name: benzenecarbothioic acid S-(3-methylbutyl) ester IUPAC Name: S-(3-methylbutyl) benzenecarbothioate Traditional Name: thiobenzoic acid S-isoamyl ester Formula: C12H16OS MolecularWeight: 208.31984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)CCSC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H16OS/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3