4-Butylaniline → HCID 178441018, compound

HRID 901914Notes

Reaction equation

HRID 901914 reaction equation
[CH3:1][S:2][C:3]1[CH:10]=[CH:9][C:6]([C:7]#[N:8])=[CH:5][CH:4]=1.[CH2:11]([C:15]1[CH:21]=[CH:20][C:18]([NH2:19])=[CH:17][CH:16]=1)[CH2:12][CH2:13][CH3:14]>>[CH2:11]([C:15]1[CH:16]=[CH:17][C:18]([NH:19][C:7]([C:6]2[CH:9]=[CH:10][C:3]([S:2][CH3:1])=[CH:4][CH:5]=2)=[NH:8])=[CH:20][CH:21]=1)[CH2:12][CH2:13][CH3:14]

Participants

3

Reactant 2

HCID 76944-ButylanilineHCID 5909604-(Methylthio)benzonitrile

Product 1

HCID 178441018HCID 178441018, compound

Procedure

The title compound was prepared from 4-methylthiobenzonitrile (1 g, 6.7 mmol) and 4-n-butylaniline (1 g, 6.7 mmol) by following the procedure described in preparation 10 (1.27 g, yield 63.66%). 1H-NMR (CDCl3):δ 0.91-0.95 (t, 3H), 1.33-1.39 (m, 2H), 1.56-1.63 (m, 2H), 2.52 (s, 3H), 2.56-2.6 (m, 2H), 4.8 (bs, 2H, D2O exchangeable), 6.88-6.9 (d, 2H), 7.15-7.17 (d, 2H), 7.27-7.29 (m, 2H), 7.79-7.81 (d, 2H). MS m/z:299.3 (M+).

Sources & evidence

ORD record
ord-c9ed3f3f4cf643d5bfae416e2ea03577
Source dataset
uspto-grants-2008_04
Patent number
US07365069B2

Reaction notes

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