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

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-2-bromanyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-2-bromo-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-acetamido-4-fluorophenyl)-2-bromo-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-2-bromo-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-2-bromo-5-pyrrolidinosulfonyl-benzamide Formula: C19H19BrFN3O4S MolecularWeight: 484.339263

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Br)F

InChI

InChI=1S/C19H19BrFN3O4S/c1-12(25)22-18-10-13(4-7-17(18)21)23-19(26)15-11-14(5-6-16(15)20)29(27,28)24-8-2-3-9-24/h4-7,10-11H,2-3,8-9H2,1H3,(H,22,25)(H,23,26)