N-cyclopropyl-2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]ethanamide

Systemtic Name: N-cyclopropyl-2-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]ethanamide Openeye Name: N-cyclopropyl-2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]acetamide CAS Name: N-cyclopropyl-2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]acetamide IUPAC Name: N-cyclopropyl-2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylsulfanyl]acetamide Traditional Name: N-cyclopropyl-2-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methylthio]acetamide Formula: C20H20FNO3S MolecularWeight: 373.441103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)CSCC2=C3C(=CC(=C2)F)CO[C@@H](O3)C4=CC=CC=C4

InChI

InChI=1S/C20H20FNO3S/c21-16-8-14-10-24-20(13-4-2-1-3-5-13)25-19(14)15(9-16)11-26-12-18(23)22-17-6-7-17/h1-5,8-9,17,20H,6-7,10-12H2,(H,22,23)/t20-/m0/s1