Hydrochloric Acid → 1,4-dihydro-1-[4-[4-(4-methoxyphenyl)-1-piperazinyl]-phenyl]-4-propyl-5H-tetrazol-5-one

HRID 1237888Notes

Reaction equation

HRID 1237888 reaction equation
[C:42](=[O:43])([O-:44])[OH:45].[Cl:1][CH2:2][CH2:3][N:4]([c:5]1[cH:6][cH:7][c:8]([O:11][CH3:12])[cH:9][cH:10]1)[CH2:13][CH2:14][Cl:15].[ClH:16].[I-:34].[K+:33].[NH2:17][c:18]1[cH:19][cH:20][c:21](-[n:24]2[n:25][n:26][n:27]([CH2:30][CH2:31][CH3:32])[c:28]2=[O:29])[cH:22][cH:23]1.[Na+:46].[OH:35][CH:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1>>[CH2:2]1[CH2:3][N:4]([c:5]2[cH:6][cH:7][c:8]([O:11][CH3:12])[cH:9][cH:10]2)[CH2:13][CH2:14][N:17]1[c:18]1[cH:19][cH:20][c:21](-[n:24]2[n:25][n:26][n:27]([CH2:30][CH2:31][CH3:32])[c:28]2=[O:29])[cH:22][cH:23]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium ionHCID 7966CyclohexanolHCID 15064N,N-Bis(2-chloroethyl)-4-methoxybenzenamineHCID 30165Iodide IonHCID 151254861-(4-aminophenyl)-4-propyl-4,5-dihydro-1H-1,2,3,4-tetrazol-5-one

Product 1

HCID 151254871,4-dihydro-1-[4-[4-(4-methoxyphenyl)-1-piperazinyl]-phenyl]-4-propyl-5H-tetrazol-5-one

Sources & evidence

ORD record
ord-b06864db097c42348c0aa39be55b55b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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