S-(3-methylbutyl) 2-sulfanylbenzenecarbothioate

Systemtic Name: S-(3-methylbutyl) 2-sulfanylbenzenecarbothioate Openeye Name: S-isopentyl 2-sulfanylbenzenecarbothioate CAS Name: 2-mercaptobenzenecarbothioic acid S-(3-methylbutyl) ester IUPAC Name: S-(3-methylbutyl) 2-sulfanylbenzenecarbothioate Traditional Name: 2-mercaptothiobenzoic acid S-isoamyl ester Formula: C12H16OS2 MolecularWeight: 240.38484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC(=O)C1=CC=CC=C1S

Isomeric SMILES

CC(C)CCSC(=O)C1=CC=CC=C1S

InChI

InChI=1S/C12H16OS2/c1-9(2)7-8-15-12(13)10-5-3-4-6-11(10)14/h3-6,9,14H,7-8H2,1-2H3