S-phenyl cyclohept-2-ene-1-carbothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C=CC1)C(=O)SC2=CC=CC=C2

Isomeric SMILES

C1CCC(C=CC1)C(=O)SC2=CC=CC=C2

InChI

InChI=1S/C14H16OS/c15-14(12-8-4-1-2-5-9-12)16-13-10-6-3-7-11-13/h3-4,6-8,10-12H,1-2,5,9H2