[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(4-fluorophenyl)sulfanylethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(4-fluorophenyl)sulfanylethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(4-fluorophenyl)sulfanylacetate CAS Name: 2-[(4-fluorophenyl)thio]acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2-(4-fluorophenyl)sulfanylacetate Traditional Name: 2-[(4-fluorophenyl)thio]acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C18H17FO3S3 MolecularWeight: 396.519183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FO3S3/c1-21-16-10-12(18-23-8-9-24-18)2-7-15(16)22-17(20)11-25-14-5-3-13(19)4-6-14/h2-7,10,18H,8-9,11H2,1H3