HCID 22614804, compound → HCID 22614814, compound

HRID 842620Notes

Reaction equation

[CH3:1][O:2][C:3]1[C:8]2[N:9]3[CH2:16][CH2:15][N:14]([CH2:17][CH2:18][NH2:19])[CH2:13][CH:10]3[CH2:11][O:12][C:7]=2[CH:6]=[CH:5][CH:4]=1.[Cl:20][C:21]1[N:22]=[C:23]2[C:29]([N:30]=[C:31]=[O:32])=[C:28]([C:33](OCC)=[O:34])[S:27][C:24]2=[N:25][CH:26]=1>>[ClH:20].[ClH:20].[CH3:1][O:2][C:3]1[C:8]2[N:9]3[CH2:16][CH2:15][N:14]([CH2:17][CH2:18][N:19]4[C:33](=[O:34])[C:28]5[S:27][C:24]6[N:25]=[CH:26][C:21]([Cl:20])=[N:22][C:23]=6[C:29]=5[NH:30][C:31]4=[O:32])[CH2:13][CH:10]3[CH2:11][O:12][C:7]=2[CH:6]=[CH:5][CH:4]=1

Participants

Reactant 2

HCID 22614804HCID 22614804, compound

HCID 22614813HCID 22614813, compound

Product 1

HCID 22614814HCID 22614814, compound

Procedure

The product from Example 13A and the product from Example 8D were processed as described in Example 1L to provide the title compound. mp 280-282° C.; [α]23D−20.9° (c 1.15,DMSO); 1H NMR (300 MHz, DMSO-d6) δ2.95-3.80 (m, 7H), 3.80 (s, 3H), 3.86-4.75 (m,6H), 6.44-6.95 (m, 3H), 9.03 (s, 1H), 10.80 (bs, 1H), 13.03 (s, 1H); MS (DCI/NH3) m/e 501 (M+H)+; Anal. calcd for C22H21N6O4SCl.2.4 HCl: C, 44.90; H, 4.01; N, 14.28. Found: C, 44.91; H, 3.70; N, 14.16.

Sources & evidence

ORD record: ord-336ba8c1fdc645fb87c3a49be670945c
Source dataset: uspto-grants-2002_04
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US06376488B1

Reaction notes

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