2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C25H26FN3O5S MolecularWeight: 499.554443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)C(=O)N

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)C(=O)N

InChI

InChI=1S/C25H26FN3O5S/c1-16-12-21(17(2)29(16)19-7-5-6-18(26)13-19)23(30)15-34-24-9-8-20(14-22(24)25(27)31)35(32,33)28-10-3-4-11-28/h5-9,12-14H,3-4,10-11,15H2,1-2H3,(H2,27,31)