5-[4-[2-(4-fluoranylphenoxy)ethanoyl]piperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one

Systemtic Name: 5-[4-[2-(4-fluoranylphenoxy)ethanoyl]piperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one Openeye Name: 5-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one CAS Name: 5-[[4-[2-(4-fluorophenoxy)-1-oxoethyl]-1-piperazinyl]sulfonyl]-1,3-dimethyl-2-benzimidazolone IUPAC Name: 5-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]sulfonyl-1,3-dimethylbenzimidazol-2-one Traditional Name: 5-[4-[2-(4-fluorophenoxy)acetyl]piperazino]sulfonyl-1,3-dimethyl-benzimidazol-2-one Formula: C21H23FN4O5S MolecularWeight: 462.494523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)F)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)F)N(C1=O)C

InChI

InChI=1S/C21H23FN4O5S/c1-23-18-8-7-17(13-19(18)24(2)21(23)28)32(29,30)26-11-9-25(10-12-26)20(27)14-31-16-5-3-15(22)4-6-16/h3-8,13H,9-12,14H2,1-2H3