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Hydrochloric Acid → N-[3-Cyano-5-methyl-4-(4-phenoxy-phenylamino)-pyrrolo[1,2-b]pyridazin-6-yl]-benzenesulfonamide

HRID 664442
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HRID 664442 반응식
[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[Cl:48][CH2:49][Cl:50].[ClH:1].[NH2:2][c:3]1[c:4]([CH3:28])[c:5]2[n:6]([n:7][cH:8][c:9]([C:25]#[N:26])[c:10]2[NH:11][c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[cH:16][cH:17]2)[cH:27]1.[c:38]1([S:44](=[O:45])(=[O:46])[Cl:47])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[NH:2]([c:3]1[c:4]([CH3:28])[c:5]2[n:6]([n:7][cH:8][c:9]([C:25]#[N:26])[c:10]2[NH:11][c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[cH:16][cH:17]2)[cH:27]1)[S:44]([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)(=[O:45])=[O:46]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 7369Benzenesulfonyl chlorideHCID 81531DiisopropylethylamineHCID 221794886-Amino-5-methyl-4-[(4-phenoxyphenyl)amino]pyrrolo[1,2-b]pyridazine-3-carbonitrile

생성물 1

HCID 22179590N-[3-Cyano-5-methyl-4-(4-phenoxy-phenylamino)-pyrrolo[1,2-b]pyridazin-6-yl]-benzenesulfonamide

출처 및 근거

ORD 기록
ord-c65e8f66553b4c86b1e5f7637c2dcc31
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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