1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylethyl]benzimidazole

Systemtic Name: 1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylethyl]benzimidazole Openeye Name: 1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylethyl]benzimidazole CAS Name: 1-[2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]sulfonyl]ethyl]benzimidazole IUPAC Name: 1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylethyl]benzimidazole Traditional Name: 1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]sulfonylethyl]benzimidazole Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)CCN4C=NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)CCN4C=NC5=CC=CC=C54

InChI

InChI=1S/C22H26N4O4S/c27-31(28,14-11-25-17-23-19-3-1-2-4-20(19)25)26-9-7-24(8-10-26)16-18-5-6-21-22(15-18)30-13-12-29-21/h1-6,15,17H,7-14,16H2