N-[(3-fluoranyl-4-methyl-phenyl)methyl]-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-3-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]propanamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-3-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)propionamide Formula: C22H24FN3O5S MolecularWeight: 461.506463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O)F

InChI

InChI=1S/C22H24FN3O5S/c1-15-4-5-16(12-18(15)23)14-24-21(27)8-11-26-19-7-6-17(13-20(19)31-22(26)28)32(29,30)25-9-2-3-10-25/h4-7,12-13H,2-3,8-11,14H2,1H3,(H,24,27)