ethyl 2-[(5-methanoyl-4-oxidanylidene-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(5-methanoyl-4-oxidanylidene-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-formyl-4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]acetate CAS Name: 2-[(5-formyl-4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-formyl-4-oxo-2-phenyl-2,3-dihydrothiopyran-6-yl)sulfanyl]acetate Traditional Name: 2-[(5-formyl-4-keto-2-phenyl-2,3-dihydrothiopyran-6-yl)thio]acetic acid ethyl ester Formula: C16H16O4S2 MolecularWeight: 336.42584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=O)CC(S1)C2=CC=CC=C2)C=O

Isomeric SMILES

CCOC(=O)CSC1=C(C(=O)CC(S1)C2=CC=CC=C2)C=O

InChI

InChI=1S/C16H16O4S2/c1-2-20-15(19)10-21-16-12(9-17)13(18)8-14(22-16)11-6-4-3-5-7-11/h3-7,9,14H,2,8,10H2,1H3