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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-(4-fluorophenyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-fluoro-anilino)-N-(4-pyridylmethyl)acetamide CAS Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-fluoroanilino)-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-fluoroanilino)-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-fluoro-anilino)-N-(4-pyridylmethyl)acetamide Formula: C22H22FN3O5S MolecularWeight: 459.490583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=NC=C2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=NC=C2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C22H22FN3O5S/c1-30-20-8-7-19(13-21(20)31-2)32(28,29)26(18-5-3-17(23)4-6-18)15-22(27)25-14-16-9-11-24-12-10-16/h3-13H,14-15H2,1-2H3,(H,25,27)