Acetonitrile → HCID 66687897, compound

HRID 206750Notes

Reaction equation

HRID 206750 reaction equation
[CH2:42]1[CH2:43][CH2:44]1.[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:45][C:46]#[N:47].[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([O:17][CH:18]([CH:19]([CH3:20])[NH2:21])[c:22]4[cH:23][cH:24][c:25]([S:28][CH3:29])[cH:26][cH:27]4)[cH:14][cH:15][c:16]23)[cH:6][cH:7]1.[S:37](=[O:38])(=[O:39])([Cl:40])[Cl:41]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]3[cH:12][c:13]([O:17][CH:18]([CH:19]([CH3:20])[NH:21][S:37](=[O:38])(=[O:39])[CH:42]4[CH2:43][CH2:44]4)[c:22]4[cH:23][cH:24][c:25]([S:28][CH3:29])[cH:26][cH:27]4)[cH:14][cH:15][c:16]23)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 6351CyclopropaneHCID 8471TriethylamineHCID 24648Sulfuryl chlorideHCID 66687502HCID 66687502, compound

Product 1

HCID 66687897HCID 66687897, compound

Sources & evidence

ORD record
ord-7f04e1d1760e4cc2915a544309bb3ee2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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