N-[4-chloranyl-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methyl-furan-3-carbothioamide

Systemtic Name: N-[4-chloranyl-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methyl-furan-3-carbothioamide Openeye Name: N-[4-chloro-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methyl-furan-3-carbothioamide CAS Name: N-[4-chloro-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methyl-3-furancarbothioamide IUPAC Name: N-[4-chloro-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methylfuran-3-carbothioamide Traditional Name: N-[4-chloro-3-[[3-(trifluoromethyl)phenoxy]methyl]phenyl]-2-methyl-furan-3-carbothioamide Formula: C20H15ClF3NO2S MolecularWeight: 425.85181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)COC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)COC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H15ClF3NO2S/c1-12-17(7-8-26-12)19(28)25-15-5-6-18(21)13(9-15)11-27-16-4-2-3-14(10-16)20(22,23)24/h2-10H,11H2,1H3,(H,25,28)