Methanol → 1-Methyl-N-[1-methyl-5-({[1-methyl-5-({[2-(4-morpholinyl)ethyl]amino}-carbonyl)-1H-pyrrol-3-yl]amino}carbonyl)-1H-pyrrol-3-yl]-4-nitro-1H-pyrrole-2-carboxamide

HRID 2310773Notes

Reaction equation

HRID 2310773 reaction equation
[CH3:1][n:2]1[c:3]([C:19](=[O:20])[NH:21][CH2:22][CH2:23][N:24]2[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2)[cH:4][c:5]([NH:7][C:8](=[O:9])[c:10]2[n:11]([CH3:18])[cH:12][c:13]([N+:15]([O-:16])=[O:17])[cH:14]2)[cH:6]1.[CH3:30][n:31]1[c:32]([C:39](=[O:40])[Cl:41])[cH:33][c:34]([N+:36](=[O:37])[O-:38])[cH:35]1.[CH3:42][OH:43].[Cl:44][CH2:45][Cl:46]>>[CH3:1][n:2]1[c:3]([C:19](=[O:20])[NH:21][CH2:22][CH2:23][N:24]2[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2)[cH:4][c:5]([NH:7][C:8](=[O:9])[c:10]2[n:11]([CH3:18])[cH:12][c:13]([NH:15][C:39]([c:32]3[n:31]([CH3:30])[cH:35][c:34]([N+:36](=[O:37])[O-:38])[cH:33]3)=[O:40])[cH:14]2)[cH:6]1

Participants

5

Reactant 4

HCID 887MethanolHCID 6344DichloromethaneHCID 108623481-Methyl-4-{[(1-methyl-4-nitro-1H-pyrrol-2-yl)carbonyl]amino}-N-[2-(4-morpholinyl)ethyl]-1H-pyrrole-2-carboxamideHCID 110631851-Methyl-4-nitro-1H-pyrrole-2-carbonyl chloride

Product 1

HCID 673927171-Methyl-N-[1-methyl-5-({[1-methyl-5-({[2-(4-morpholinyl)ethyl]amino}-carbonyl)-1H-pyrrol-3-yl]amino}carbonyl)-1H-pyrrol-3-yl]-4-nitro-1H-pyrrole-2-carboxamide

Sources & evidence

ORD record
ord-c82182a189c44ffba58905c62be15ee6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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