Dimethyl Sulfoxide → 1-[1-(2-Methyl-7,8-dihydro-1,6,9-trioxa-3-aza-cyclopenta[a]naphthalen-8-ylmethyl)-piperidin-4-yl]-1,3-dihydro-2H-benzimidazol-2-one

HRID 172629Notes

Reaction equation

HRID 172629 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH:13]2[O:14][c:15]3[c:16]([cH:17][cH:18][c:19]4[n:20][c:21]([CH3:24])[o:22][c:23]34)[O:25][CH2:26]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:43][S:44]([CH3:45])=[O:46].[O:27]=[c:28]1[nH:29][c:30]2[c:31]([n:32]1[CH:33]1[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1)[cH:39][cH:40][cH:41][cH:42]2>>[CH2:12]([CH:13]1[O:14][c:15]2[c:16]([cH:17][cH:18][c:19]3[n:20][c:21]([CH3:24])[o:22][c:23]23)[O:25][CH2:26]1)[N:36]1[CH2:35][CH2:34][CH:33]([n:32]2[c:28](=[O:27])[nH:29][c:30]3[c:31]2[cH:39][cH:40][cH:41][cH:42]3)[CH2:38][CH2:37]1

Participants

4

Reactant 3

HCID 679Dimethyl SulfoxideHCID 886381,3-Dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-oneHCID 11268854[2-Methyl-7,8-dihydro[1,4]dioxino[2,3-g][1,3]benzoxazol-8-yl]methyl 4-methylbenzenesulfonate

Product 1

HCID 102736431-[1-(2-Methyl-7,8-dihydro-1,6,9-trioxa-3-aza-cyclopenta[a]naphthalen-8-ylmethyl)-piperidin-4-yl]-1,3-dihydro-2H-benzimidazol-2-one

Sources & evidence

ORD record
ord-9bd1ad950ee94af5a3c10647f5403347
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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