5-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoranyl-benzamide Openeye Name: 5-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoro-benzamide CAS Name: 5-bromo-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-fluorobenzamide IUPAC Name: 5-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-fluorobenzamide Traditional Name: 5-bromo-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-fluoro-benzamide Formula: C19H20BrFN2O4S MolecularWeight: 471.340503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H20BrFN2O4S/c1-2-27-17-8-6-14(12-18(17)28(25,26)23-9-3-4-10-23)22-19(24)15-11-13(20)5-7-16(15)21/h5-8,11-12H,2-4,9-10H2,1H3,(H,22,24)