Hydrochloric Acid → HCID 25182930, compound

HRID 1537973Notes

Reaction equation

HRID 1537973 reaction equation
[C:33]([CH3:34])([CH3:35])([CH3:36])[O:37][C:38]([CH2:39][CH2:40][NH2:41])=[O:42].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH:1]1([N:7]([c:8]2[cH:9][c:10]([C:14](=[O:15])[NH:16][c:17]3[c:18]([CH3:27])[cH:19][c:20]([S:23](=[O:24])(=[O:25])[Cl:26])[cH:21][cH:22]3)[n:11][cH:12][n:13]2)[CH2:28][CH:29]2[CH2:30][CH2:31]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:32]>>[CH:1]1([N:7]([c:8]2[cH:9][c:10]([C:14](=[O:15])[NH:16][c:17]3[c:18]([CH3:27])[cH:19][c:20]([S:23](=[O:24])(=[O:25])[NH:41][CH2:40][CH2:39][C:38]([O:37][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:42])[cH:21][cH:22]3)[n:11][cH:12][n:13]2)[CH2:28][CH:29]2[CH2:30][CH2:31]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 4192171tert-Butyl 3-aminopropanoateHCID 594468814-[({6-[Cyclohexyl(cyclopropylmethyl)amino]pyrimidin-4-yl}carbonyl)amino]-3-methylbenzenesulfonyl chloride

Product 1

HCID 25182930HCID 25182930, compound

Sources & evidence

ORD record
ord-e3447552bad04695bf5909b80f6d68a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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