[(1R,6S)-3,4-dimethyl-1-oxidanylidene-6-phenyl-2,5-dihydrothiopyran-6-yl] thiocyanate

Systemtic Name: [(1R,6S)-3,4-dimethyl-1-oxidanylidene-6-phenyl-2,5-dihydrothiopyran-6-yl] thiocyanate Openeye Name: [(1R,6S)-3,4-dimethyl-1-oxo-6-phenyl-2,5-dihydrothiopyran-6-yl] thiocyanate CAS Name: thiocyanic acid [(1R,6S)-3,4-dimethyl-1-oxo-6-phenyl-2,5-dihydrothiopyran-6-yl] ester IUPAC Name: [(1R,6S)-3,4-dimethyl-1-oxo-6-phenyl-2,5-dihydrothiopyran-6-yl] thiocyanate Traditional Name: thiocyanic acid [(1R,6S)-1-keto-3,4-dimethyl-6-phenyl-2,5-dihydrothiopyran-6-yl] ester Formula: C14H15NOS2 MolecularWeight: 277.405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CS(=O)C(C1)(C2=CC=CC=C2)SC#N)C

Isomeric SMILES

CC1=C(C[S@@](=O)[C@@](C1)(C2=CC=CC=C2)SC#N)C

InChI

InChI=1S/C14H15NOS2/c1-11-8-14(17-10-15,18(16)9-12(11)2)13-6-4-3-5-7-13/h3-7H,8-9H2,1-2H3/t14-,18+/m0/s1