S-(4-bromophenyl) 2-(4-ethyl-2-methyl-6-oxidanylidene-2,3-dihydropyran-5-yl)ethanethioate

Systemtic Name: S-(4-bromophenyl) 2-(4-ethyl-2-methyl-6-oxidanylidene-2,3-dihydropyran-5-yl)ethanethioate Openeye Name: S-(4-bromophenyl) 2-(4-ethyl-2-methyl-6-oxo-2,3-dihydropyran-5-yl)ethanethioate CAS Name: 2-(4-ethyl-2-methyl-6-oxo-2,3-dihydropyran-5-yl)ethanethioic acid S-(4-bromophenyl) ester IUPAC Name: S-(4-bromophenyl) 2-(4-ethyl-2-methyl-6-oxo-2,3-dihydropyran-5-yl)ethanethioate Traditional Name: 2-(4-ethyl-6-keto-2-methyl-2,3-dihydropyran-5-yl)ethanethioic acid S-(4-bromophenyl) ester Formula: C16H17BrO3S MolecularWeight: 369.27338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)OC(C1)C)CC(=O)SC2=CC=C(C=C2)Br

Isomeric SMILES

CCC1=C(C(=O)OC(C1)C)CC(=O)SC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H17BrO3S/c1-3-11-8-10(2)20-16(19)14(11)9-15(18)21-13-6-4-12(17)5-7-13/h4-7,10H,3,8-9H2,1-2H3