4-[4-cyano-5-[(4-fluorophenyl)methylamino]-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-cyano-5-[(4-fluorophenyl)methylamino]-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[4-cyano-5-[(4-fluorophenyl)methylamino]oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[4-cyano-5-[(4-fluorophenyl)methylamino]-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[4-cyano-5-[(4-fluorophenyl)methylamino]-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[4-cyano-5-[(4-fluorobenzyl)amino]oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC=C(C=C3)F)C#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C21H21FN4O3S/c1-3-26(4-2)30(27,28)18-11-7-16(8-12-18)20-25-19(13-23)21(29-20)24-14-15-5-9-17(22)10-6-15/h5-12,24H,3-4,14H2,1-2H3