1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanone Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-(5-isopropyl-6-methyl-benzofuran-3-yl)ethanone CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-2-(6-methyl-5-propan-2-yl-3-benzofuranyl)ethanone IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanone Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]-2-(5-isopropyl-6-methyl-benzofuran-3-yl)ethanone Formula: C26H30N2O6S MolecularWeight: 498.5912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC=C2CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)OC=C2CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5)C(C)C

InChI

InChI=1S/C26H30N2O6S/c1-17(2)21-15-22-19(16-34-24(22)12-18(21)3)13-26(29)27-6-8-28(9-7-27)35(30,31)20-4-5-23-25(14-20)33-11-10-32-23/h4-5,12,14-17H,6-11,13H2,1-3H3