Hydrochloric Acid → Ethyl 2-(8-carbamoyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazin-3(4H)-yl)acetate

HRID 1234141Notes

Reaction equation

HRID 1234141 reaction equation
[CH3:46][C:47]#[N:48].[ClH:45].[I:38][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44].[N:1]1([CH:2]2[CH2:3][CH2:4][CH2:5][CH:6]=[CH:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]2)[CH2:13][CH2:14][CH2:15][N:16]=[CH:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]1.[OH:23][CH2:24][n:25]1[n:26][n:27][c:28]2[n:29]([c:30]1=[O:31])[cH:32][n:33][c:34]2[C:35](=[O:36])[NH2:37]>>[CH2:24]([n:25]1[n:26][n:27][c:28]2[n:29]([c:30]1=[O:31])[cH:32][n:33][c:34]2[C:35](=[O:36])[NH2:37])[C:40](=[O:41])[O:42][CH2:43][CH3:44]

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 12183Ethyl iodoacetateHCID 441283003-(Hydroxymethyl)-4-oxo-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamideHCID 666088091-Cycloundec-5-en-1-yl-1,5-diazacycloundec-5-ene

Product 1

HCID 10978381Ethyl 2-(8-carbamoyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazin-3(4H)-yl)acetate

Sources & evidence

ORD record
ord-c4b0f5564f514ca6b60071615567c5e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…