Chloride → HCID 25165321, compound

HRID 1236999Notes

Reaction equation

HRID 1236999 reaction equation
[C:1]([BH3-:2])#[N:3].[CH3:42][OH:43].[Cl-:44].[Cl-:46].[ClH:18].[NH2:19][CH2:20][C:21](=[O:22])[N:23]1[CH2:24][CH2:25][N:26]([C:29]([c:30]2[c:31]([C:37]([F:38])([F:39])[F:40])[cH:32][cH:33][c:34]([F:36])[cH:35]2)=[O:41])[CH2:27][CH2:28]1.[Na+:4].[Zn+2:45].[c:5]1(-[n:11]2[n:12][cH:13][c:14]([CH:16]=[O:17])[cH:15]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[c:5]1(-[n:11]2[n:12][cH:13][c:14]([CH2:16][NH:19][CH2:20][C:21](=[O:22])[N:23]3[CH2:24][CH2:25][N:26]([C:29]([c:30]4[c:31]([C:37]([F:38])([F:39])[F:40])[cH:32][cH:33][c:34]([F:36])[cH:35]4)=[O:41])[CH2:27][CH2:28]3)[cH:15]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1

Participants

9

Reactant 8

HCID 312Chloride2×HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 32051Zinc(2+)HCID 498716Cyano-borohydrideHCID 9520891-Phenyl-1H-pyrazole-4-carbaldehydeHCID 595595982-Amino-1-[4-(2-trifluoromethyl-5-fluoro-benzoyl)-piperazin-1-yl]-ethanone

Product 1

HCID 25165321HCID 25165321, compound

Sources & evidence

ORD record
ord-f8d2cd9155e849b58788c18fc7b681bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…