[4-[(4-methoxyphenyl)methylsulfanyl]thian-2-yl] ethanoate

Systemtic Name: [4-[(4-methoxyphenyl)methylsulfanyl]thian-2-yl] ethanoate Openeye Name: [4-[(4-methoxyphenyl)methylsulfanyl]tetrahydrothiopyran-2-yl] acetate CAS Name: acetic acid [4-[(4-methoxyphenyl)methylthio]-2-thianyl] ester IUPAC Name: [4-[(4-methoxyphenyl)methylsulfanyl]thian-2-yl] acetate Traditional Name: acetic acid [4-(p-anisylthio)tetrahydrothiopyran-2-yl] ester Formula: C15H20O3S2 MolecularWeight: 312.4475

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(CCS1)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)OC1CC(CCS1)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H20O3S2/c1-11(16)18-15-9-14(7-8-19-15)20-10-12-3-5-13(17-2)6-4-12/h3-6,14-15H,7-10H2,1-2H3