(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-N-(4-pyrrolidinosulfonylphenyl)acrylamide Formula: C19H18BrFN2O3S MolecularWeight: 453.325223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C19H18BrFN2O3S/c20-15-4-9-18(21)14(13-15)3-10-19(24)22-16-5-7-17(8-6-16)27(25,26)23-11-1-2-12-23/h3-10,13H,1-2,11-12H2,(H,22,24)/b10-3+