Methyl chloroformate → {3-[6-Benzyloxy-7-(1,1,4-trioxo-1,2,5-thiadiazolidin-2-yl)-naphthalen-2-yl]-benzyl}-carbamic acid methyl ester

HRID 195130Notes

Reaction equation

HRID 195130 reaction equation
[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:42][C:43](=[O:44])[O:45][CH3:46].[NH2:1][CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]3[cH:13][c:14]([O:27][CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[c:15]([N:19]4[CH2:20][C:21](=[O:26])[NH:22][S:23]4(=[O:24])=[O:25])[cH:16][c:17]3[cH:18]2)[cH:6][cH:7][cH:8]1>>[NH:1]([CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]3[cH:13][c:14]([O:27][CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[c:15]([N:19]4[CH2:20][C:21](=[O:26])[NH:22][S:23]4(=[O:24])=[O:25])[cH:16][c:17]3[cH:18]2)[cH:6][cH:7][cH:8]1)[C:43](=[O:44])[O:45][CH3:46]

Participants

5

Reactant 4

HCID 6586Methyl chloroformateHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 667509055-[7-(3-Aminomethylphenyl)-3-benzyloxynaphthalen-2-yl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one

Product 1

HCID 66750635{3-[6-Benzyloxy-7-(1,1,4-trioxo-1,2,5-thiadiazolidin-2-yl)-naphthalen-2-yl]-benzyl}-carbamic acid methyl ester

Sources & evidence

ORD record
ord-5558e6562c1a48818e6be813d87d7def
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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