Chloride → 2-[(Cyclopropylcarbonyl)amino]-1,3-benzothiazol-6-yl thiocyanate

HRID 180178

Reaction equation

HRID 180178 reaction equation
[CH:15]1([C:18](=[O:19])[OH:20])[CH2:16][CH2:17]1.[Cl-:14].[NH2:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([S:11][C:12]#[N:13])[cH:10]2.[cH:21]1[cH:22][cH:23][n:24][cH:25][cH:26]1>>[NH:1]([c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([S:11][C:12]#[N:13])[cH:10]2)[C:18]([CH:15]1[CH2:16][CH2:17]1)=[O:19]

Participants

5

Reactant 4

HCID 312ChlorideHCID 1049PyridineHCID 15655Cyclopropanecarboxylic acidHCID 816002-Amino-6-thiocyanato-1,3-benzothiazole

Product 1

HCID 866478942-[(Cyclopropylcarbonyl)amino]-1,3-benzothiazol-6-yl thiocyanate

Sources & evidence

ORD record
ord-541669f5255c40fe818c6b8d5999cd63
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

Loading…