2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-fluorophenyl)amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-fluorophenyl)amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoro-anilino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoro-anilino]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C26H26FN3O7S2 MolecularWeight: 575.628943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC=C(C=C3)F)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=CC=C(C=C3)F)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H26FN3O7S2/c27-19-3-7-21(8-4-19)30(39(34,35)23-11-12-24-25(17-23)37-16-15-36-24)18-26(31)28-20-5-9-22(10-6-20)38(32,33)29-13-1-2-14-29/h3-12,17H,1-2,13-16,18H2,(H,28,31)