Tetrahydrofuran → N-{[(2-{4-[(4,6-dimethyl-{[(methylamino)carbonothioyl]amino}-2-pyridinyl)amino]phenyl}ethyl)amino]carbonyl}-4-methylbenzenesulfonamide

HRID 185957Notes

Reaction equation

HRID 185957 reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:33][N:34]=[C:35]=[S:36].[NH2:1][c:2]1[c:3]([NH:10][c:11]2[cH:12][cH:13][c:14]([CH2:17][CH2:18][NH:19][C:20](=[O:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]3[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]3)[cH:15][cH:16]2)[n:4][c:5]([CH3:9])[cH:6][c:7]1[CH3:8]>>[NH:1]([c:2]1[c:3]([NH:10][c:11]2[cH:12][cH:13][c:14]([CH2:17][CH2:18][NH:19][C:20](=[O:21])[NH:22][S:23](=[O:24])(=[O:25])[c:26]3[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]3)[cH:15][cH:16]2)[n:4][c:5]([CH3:9])[cH:6][c:7]1[CH3:8])[C:35]([NH:34][CH3:33])=[S:36]

Participants

4

Reactant 3

HCID 8028TetrahydrofuranHCID 11167Methyl isothiocyanateHCID 218756203-Amino-4,6-dimethyl-2-(4-{2-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]ethyl}anilino)pyridine

Product 1

HCID 21876256N-{[(2-{4-[(4,6-dimethyl-{[(methylamino)carbonothioyl]amino}-2-pyridinyl)amino]phenyl}ethyl)amino]carbonyl}-4-methylbenzenesulfonamide

Sources & evidence

ORD record
ord-42ceaf019bc94bc7ae7e3502c8814084
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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