N-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[4-(4-fluorophenyl)piperazino]sulfonyl-benzamide Formula: C24H22FN3O5S MolecularWeight: 483.511983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H22FN3O5S/c25-18-4-7-20(8-5-18)27-10-12-28(13-11-27)34(30,31)21-3-1-2-17(14-21)24(29)26-19-6-9-22-23(15-19)33-16-32-22/h1-9,14-15H,10-13,16H2,(H,26,29)