N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-1-(4-fluorophenyl)methanesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-1-(4-fluorophenyl)methanesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1-(4-fluorophenyl)methanesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1-(4-fluorophenyl)methanesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1-(4-fluorophenyl)methanesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1-(4-fluorophenyl)methanesulfonamide Formula: C20H18FNO6S3 MolecularWeight: 483.553423

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CNS(=O)(=O)CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CNS(=O)(=O)CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H18FNO6S3/c21-16-6-3-14(4-7-16)12-30(23,24)22-11-19(31(25,26)20-2-1-9-29-20)15-5-8-17-18(10-15)28-13-27-17/h1-10,19,22H,11-13H2