Benzene → HCID 13307194, compound
Reaction equation
[CH2:17]1[CH2:18][NH:19][CH2:20][CH2:21][NH:22]1.[Cl:1][c:2]1[n:3][c:4]([N:12]2[CH2:13][CH2:14][CH2:15][CH2:16]2)[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][CH2:10][S:11]2.[cH:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[c:2]1([N:19]2[CH2:18][CH2:17][NH:22][CH2:21][CH2:20]2)[n:3][c:4]([N:12]2[CH2:13][CH2:14][CH2:15][CH2:16]2)[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][CH2:10][S:11]2Participants
4
Sources & evidence
- ORD record
- ord-1c0cfbd52ad2481ab98bd377cbccdede
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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