2-Isopropylaniline → HCID 44213937, compound

HRID 307212Notes

Reaction equation

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

Participants

Reactant 2

HCID 125612-Isopropylaniline

HCID 54262869HCID 54262869, compound

Product 1

HCID 44213937HCID 44213937, compound

Sources & evidence

ORD record: ord-d4db6049c14e4372a930fd8981c8c03d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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