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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-1-(3-chlorophenyl)methanesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1-(3-chlorophenyl)methanesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1-(3-chlorophenyl)methanesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1-(3-chlorophenyl)methanesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1-(3-chlorophenyl)methanesulfonamide Formula: C20H18ClNO6S3 MolecularWeight: 500.00802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClNO6S3/c21-16-4-1-3-14(9-16)12-30(23,24)22-11-19(31(25,26)20-5-2-8-29-20)15-6-7-17-18(10-15)28-13-27-17/h1-10,19,22H,11-13H2