Cyclamate → 1-(1-n-Butyl-2-pyrrolidylidene)-3-(2,6-dimethylphenyl)urea

반응식

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

참가 물질

반응물 3

HCID 7533Cyclamate

HCID 987872,6-Xylyl isocyanate

HCID 124490221-n-Butyl-2-iminopyrrolidine

생성물 1

HCID 537610961-(1-n-Butyl-2-pyrrolidylidene)-3-(2,6-dimethylphenyl)urea

출처 및 근거

ORD 기록: ord-c120f29c6c9d46c9b4453a4e03b97156
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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