2-[(4-cyano-3-fluoranyl-phenyl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)-N-(phenylsulfonyl)ethanamide

Systemtic Name: 2-[(4-cyano-3-fluoranyl-phenyl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)-N-(phenylsulfonyl)ethanamide Openeye Name: N-(benzenesulfonyl)-2-(4-cyano-3-fluoro-anilino)-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide CAS Name: N-(benzenesulfonyl)-2-(4-cyano-3-fluoroanilino)-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide IUPAC Name: N-(benzenesulfonyl)-2-(4-cyano-3-fluoroanilino)-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide Traditional Name: N-besyl-2-(4-cyano-3-fluoro-anilino)-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide Formula: C26H26FN3O5S MolecularWeight: 511.565143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=CC=C2)NC3=CC(=C(C=C3)C#N)F)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=CC=C2)NC3=CC(=C(C=C3)C#N)F)OC(C)C

InChI

InChI=1S/C26H26FN3O5S/c1-4-34-24-14-18(11-13-23(24)35-17(2)3)25(29-20-12-10-19(16-28)22(27)15-20)26(31)30-36(32,33)21-8-6-5-7-9-21/h5-15,17,25,29H,4H2,1-3H3,(H,30,31)