2-[(3,4-dimethoxyphenyl)sulfonyl-(2-fluorophenyl)amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-fluorophenyl)amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoro-anilino)-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoroanilino)-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoroanilino)-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoro-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C25H27FN2O5S2 MolecularWeight: 518.620683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3F)OC

InChI

InChI=1S/C25H27FN2O5S2/c1-32-23-14-13-20(17-24(23)33-2)35(30,31)28(22-12-7-6-11-21(22)26)18-25(29)27-15-8-16-34-19-9-4-3-5-10-19/h3-7,9-14,17H,8,15-16,18H2,1-2H3,(H,27,29)