Acetonitrile → HCID 21183965, compound

HRID 102233Notes

Reaction equation

HRID 102233 reaction equation
[C:5]([NH2:6])(=[O:7])[CH:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]3[cH:17][cH:18][c:19]([Cl:35])[cH:20][c:21]3[c:22]([NH:24][CH2:25][c:26]3[cH:27][c:28]4[c:29]([cH:30][cH:31]3)[O:32][CH2:33][O:34]4)[n:23]2)[CH2:12][CH2:13]1.[CH3:36][C:37]#[N:38].[S:1]([Cl:2])([Cl:3])=[O:4]>>[C:5](#[N:6])[CH:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]3[cH:17][cH:18][c:19]([Cl:35])[cH:20][c:21]3[c:22]([NH:24][CH2:25][c:26]3[cH:27][c:28]4[c:29]([cH:30][cH:31]3)[O:32][CH2:33][O:34]4)[n:23]2)[CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 24386Thionyl ChlorideHCID 21183891HCID 21183891, compound

Product 1

HCID 21183965HCID 21183965, compound

Sources & evidence

ORD record
ord-1f2e4b9c2ffb45fea5eef4a22741a30f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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