methyl N-[3-fluoranyl-4-(4-oxidanylthian-4-yl)phenyl]carbamate

Systemtic Name: methyl N-[3-fluoranyl-4-(4-oxidanylthian-4-yl)phenyl]carbamate Openeye Name: methyl N-[3-fluoro-4-(4-hydroxytetrahydrothiopyran-4-yl)phenyl]carbamate CAS Name: N-[3-fluoro-4-(4-hydroxy-4-thianyl)phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-fluoro-4-(4-hydroxythian-4-yl)phenyl]carbamate Traditional Name: N-[3-fluoro-4-(4-hydroxytetrahydrothiopyran-4-yl)phenyl]carbamic acid methyl ester Formula: C13H16FNO3S MolecularWeight: 285.334443

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC(=C(C=C1)C2(CCSCC2)O)F

Isomeric SMILES

COC(=O)NC1=CC(=C(C=C1)C2(CCSCC2)O)F

InChI

InChI=1S/C13H16FNO3S/c1-18-12(16)15-9-2-3-10(11(14)8-9)13(17)4-6-19-7-5-13/h2-3,8,17H,4-7H2,1H3,(H,15,16)