Methanol → HCID 178438903, compound

HRID 530271Notes

Reaction equation

HRID 530271 reaction equation
[CH3:1][C:2]1[N:3]=[C:4]([C:14]2[CH:19]=[CH:18][C:17]([CH2:20][CH2:21][CH2:22]CCCCCC)=[CH:16][CH:15]=2)[S:5][C:6]=1[C:7](=[N:9][NH:10][C:11](=[NH:13])[NH2:12])[CH3:8].CO>O>[CH3:1][C:2]1[N:3]=[C:4]([C:14]2[CH:15]=[CH:16][C:17]([CH2:20][CH2:21][CH3:22])=[CH:18][CH:19]=2)[S:5][C:6]=1[C:7](=[N:9][NH:10][C:11](=[NH:12])[NH2:13])[CH3:8]

Participants

4

Reactant 2

HCID 887MethanolHCID 178442721HCID 178442721, compound

Product 1

HCID 178438903HCID 178438903, compound

Reagents, catalysts & solvents 1

HCID 962WaterSolvent

Procedure

2-{1-[4-Methyl-2-(4-nonylphenyl)thiazol-5-yl]ethylidenehydrazinecarboximid-amide (1f). Yellow solid (133 mg, 55%): mp 203-206° C. 1H NMR (DMSO-d6) δ 11.32 (brs, 1 H), 7.79 (d, J=8.1 Hz, 2 H), 7.60 (brs, 3 H), 7.28 (d, J=8.1 Hz, 2 H), 2.58 (m, 5 H), 2.41 (s, 3 H), 1.55 (m, 2 H), 1.22 (m, 12 H), 0.82 (t, J=6.9 Hz, 3 H); 13C NMR (DMSO-d6) δ 165.80, 156.87, 153.45, 147.99, 146.28, 131.19, 131.60, 129.44, 126.25, 36.34, 35.29, 31.60, 30.98, 29.28, 29.19, 28.99, 22.42, 18.46, 18.39, 14.27; ESIMS m/z (rel intensity) 400 (MH+, 100); HRESIMS, m/z 400.2540 MH+, calcd for C22H34N5S 400.2535; HPLC purity (methanol:water, 1:1): 95.40%.

Sources & evidence

ORD record
ord-e9b99819abc245b19f29f8f0b6a9321d
Source dataset
uspto-grants-2016_05
Patent number
US09353072B2

Reaction notes

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