Acetonitrile → HCID 58389176, compound

HRID 2141658Notes

Reaction equation

HRID 2141658 reaction equation
[CH2:32]1[CH2:33][O:34][CH2:35][CH2:36][NH:37]1.[CH3:1][S:2]([O:3][CH2:6][c:7]1[n:8][o:9][c:10]([CH2:12][O:13][c:14]2[c:15]3[c:19]([cH:20][cH:21][cH:22]2)[C:18](=[O:23])[N:17]([CH:24]2[C:25](=[O:31])[NH:26][C:27](=[O:30])[CH2:28][CH2:29]2)[CH2:16]3)[cH:11]1)(=[O:4])=[O:5].[CH3:47][C:48]#[N:49].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46]>>[CH2:6]([c:7]1[n:8][o:9][c:10]([CH2:12][O:13][c:14]2[c:15]3[c:19]([cH:20][cH:21][cH:22]2)[C:18](=[O:23])[N:17]([CH:24]2[C:25](=[O:31])[NH:26][C:27](=[O:30])[CH2:28][CH2:29]2)[CH2:16]3)[cH:11]1)[N:37]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8083MorpholineHCID 81531DiisopropylethylamineHCID 86656505HCID 86656505, compound

Product 1

HCID 58389176HCID 58389176, compound

Sources & evidence

ORD record
ord-1d12e94be410409ea1595f1e523b70ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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