N-(1-adamantyl)-2-[(3,4-dimethoxyphenyl)sulfonyl-(2-fluorophenyl)amino]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[(3,4-dimethoxyphenyl)sulfonyl-(2-fluorophenyl)amino]ethanamide Openeye Name: N-(1-adamantyl)-2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoro-anilino)acetamide CAS Name: N-(1-adamantyl)-2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoroanilino)acetamide IUPAC Name: N-(1-adamantyl)-2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoroanilino)acetamide Traditional Name: N-(1-adamantyl)-2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoro-anilino)acetamide Formula: C26H31FN2O5S MolecularWeight: 502.598143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5F)OC

InChI

InChI=1S/C26H31FN2O5S/c1-33-23-8-7-20(12-24(23)34-2)35(31,32)29(22-6-4-3-5-21(22)27)16-25(30)28-26-13-17-9-18(14-26)11-19(10-17)15-26/h3-8,12,17-19H,9-11,13-16H2,1-2H3,(H,28,30)