4-[[3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carbaldehyde Openeye Name: 4-[[3-[2-(4-fluorophenyl)-2-oxo-ethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carbaldehyde CAS Name: 4-[[3-[2-(4-fluorophenyl)-2-oxoethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[[3-[2-(4-fluorophenyl)-2-oxoethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carbaldehyde Traditional Name: 4-[[3-[2-(4-fluorophenyl)-2-keto-ethyl]-2-keto-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carbaldehyde Formula: C20H18FN3O6S MolecularWeight: 447.436823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H18FN3O6S/c21-15-3-1-14(2-4-15)18(26)12-24-17-6-5-16(11-19(17)30-20(24)27)31(28,29)23-9-7-22(13-25)8-10-23/h1-6,11,13H,7-10,12H2