2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C20H23ClFN3O3S MolecularWeight: 439.931323

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23ClFN3O3S/c1-24(13-17-18(21)8-5-9-19(17)22)14-20(26)23-15-6-4-7-16(12-15)29(27,28)25-10-2-3-11-25/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,23,26)