2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide

Systemtic Name: 2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide Openeye Name: 2-(4-fluoro-N-methylsulfonyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide CAS Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]butanamide IUPAC Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide Traditional Name: 2-(4-fluoro-N-mesyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butyramide Formula: C22H26FN3O4S MolecularWeight: 447.522943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)N2CCCC2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)N2CCCC2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C22H26FN3O4S/c1-3-20(26(31(2,29)30)17-12-10-16(23)11-13-17)21(27)24-19-9-5-4-8-18(19)22(28)25-14-6-7-15-25/h4-5,8-13,20H,3,6-7,14-15H2,1-2H3,(H,24,27)