[1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methanol

Systemtic Name: [1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methanol Openeye Name: [1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methanol CAS Name: [1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]methyl]-2-benzimidazolyl]methanol IUPAC Name: [1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methanol Traditional Name: [1-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazino]methyl]benzimidazol-2-yl]methanol Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)CN4C5=CC=CC=C5N=C4CO)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)CN4C5=CC=CC=C5N=C4CO)OC1

InChI

InChI=1S/C22H26N4O5S/c27-15-22-23-18-4-1-2-5-19(18)26(22)16-24-8-10-25(11-9-24)32(28,29)17-6-7-20-21(14-17)31-13-3-12-30-20/h1-2,4-7,14,27H,3,8-13,15-16H2