3-Isopropylaniline → HCID 178466332, compound

HRID 2140327Notes

Reaction equation

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

Participants

Reactant 2

HCID 4586793-Isopropylaniline

HCID 178466389HCID 178466389, compound

Product 1

HCID 178466332HCID 178466332, compound

Sources & evidence

ORD record: ord-c3c9f09963b741289f3f7e7f4c99780f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…