2-Methylphenyl isothiocyanate → HCID 58651301, compound

HRID 2087766Notes

Reaction equation

HRID 2087766 reaction equation
[N:1]([C:4]1[CH:9]=[CH:8][CH:7]=[CH:6][C:5]=1[CH3:10])=[C:2]=[S:3].[NH2:11][C@H:12]([C:33]1[CH:38]=[CH:37][CH:36]=[CH:35][CH:34]=1)[CH2:13][CH2:14][N:15]1[CH2:20][CH2:19][CH:18]([C:21]2[CH:22]=[C:23]([NH:27][C:28](=[O:32])[CH:29]([CH3:31])[CH3:30])[CH:24]=[CH:25][CH:26]=2)[CH2:17][CH2:16]1>>[CH3:30][CH:29]([CH3:31])[C:28]([NH:27][C:23]1[CH:24]=[CH:25][CH:26]=[C:21]([CH:18]2[CH2:17][CH2:16][N:15]([CH2:14][CH2:13][C@@H:12]([C:33]3[CH:34]=[CH:35][CH:36]=[CH:37][CH:38]=3)[NH:11][C:2]([NH:1][C:4]3[C:5]([CH3:10])=[CH:6][CH:7]=[CH:8][CH:9]=3)=[S:3])[CH2:20][CH2:19]2)[CH:22]=1)=[O:32]

Participants

3

Reactant 2

HCID 691952-Methylphenyl isothiocyanateHCID 69523474N-(3-(1-[(3S)-3-amino-3-phenylpropyl]-4-piperidinyl)phenyl)-2-methylpropanamide

Product 1

HCID 58651301HCID 58651301, compound

Procedure

Prepared by Procedure P and Scheme AB using 1-isothiocyanato-2-methylbenzene and N-(3-{1-[(3S)-3-amino-3-phenylpropyl]-4-piperidinyl}phenyl)-2-methylpropanamide: ESMS m/e: 529.1 (M+H)+.

Workup

  1. customPrepared by Procedure P and Scheme AB

Sources & evidence

ORD record
ord-870f831b8c4e4fa4b7d604fb929069fd
Source dataset
uspto-grants-2004_04
Patent number
US06727264B1

Reaction notes

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