S-phenyl 3-methylcyclohex-2-ene-1-carbothioate

Systemtic Name: S-phenyl 3-methylcyclohex-2-ene-1-carbothioate Openeye Name: S-phenyl 3-methylcyclohex-2-ene-1-carbothioate CAS Name: 3-methyl-1-cyclohex-2-enecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 3-methylcyclohex-2-ene-1-carbothioate Traditional Name: 3-methylcyclohex-2-ene-1-carbothioic acid S-phenyl ester Formula: C14H16OS MolecularWeight: 232.34124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(CCC1)C(=O)SC2=CC=CC=C2

Isomeric SMILES

CC1=CC(CCC1)C(=O)SC2=CC=CC=C2

InChI

InChI=1S/C14H16OS/c1-11-6-5-7-12(10-11)14(15)16-13-8-3-2-4-9-13/h2-4,8-10,12H,5-7H2,1H3