Hydrochloric Acid → HCID 9891491, compound

HRID 677068Notes

Reaction equation

HRID 677068 reaction equation
[CH2:1]1[O:2][c:3]2[cH:4][c:5]3[c:6]([cH:17][c:18]2[O:19]1)[CH2:7][CH:8]([C:14](=[O:15])[OH:16])[S:9][CH:10]([CH3:13])[C:11]3=[O:12].[CH2:36]([N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45])[CH3:46].[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[CH:62]([Cl:63])([Cl:64])[Cl:65].[ClH:35].[NH2:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][CH:26]2[C:27](=[O:32])[NH:28][C:29](=[O:31])[S:30]2)[cH:33][cH:34]1.[OH:47][n:48]1[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]3[c:6]([cH:17][c:18]2[O:19]1)[CH2:7][CH:8]([C:14](=[O:16])[NH:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][CH:26]2[C:27](=[O:32])[NH:28][C:29](=[O:31])[S:30]2)[cH:33][cH:34]1)[S:9][CH:10]([CH3:13])[C:11]3=[O:12]

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6212ChloroformHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 27683775-[(4-Aminophenyl)methyl]-1,3-thiazolidine-2,4-dioneHCID 159224451,2,4,5-Tetrahydro-4-methyl-7,8-methylenedioxy-5-oxo-3-benzothiepin-2-carboxylic acid

Product 1

HCID 9891491HCID 9891491, compound

Sources & evidence

ORD record
ord-c471e7aba5424ec798290c84ce85f33c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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