(C5Me5)2U[=N-2,6-(i-Pr)2C6H3](SPh)

Properties Image MNX_ID MNXM31432 reference chebi:53191 formula C38H52NSU global charge 0 mol weight 792.937 InChIKey UEOYTEXAPNFGHU-UHFFFAOYSA-M InChI InChI=1S/C12H17N.2C10H15.C6H6S.U/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;2*1-6-7(2)9(4)10(5)8(6)3;7-6-4-2-1-3-5-6;/h5-9H,1-4H3;2*1-5H3;1-5,7H;/q;;;;+1/p-1 SMILES CC(C)C1=CC=CC(C(C)C)=C1N=[U]12345678(SC9=CC=CC=C9)(C9(C)C1(C)C2(C)C3(C)C94C)C1(C)C5(C)C6(C)C7(C)C18C MNX internals InChI (mnx) InChI=1/C12H17N.2C10H15.C6H6S.U/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;2*1-6-7(2)9(4)10(5)8(6)3;7-6-4-2-1-3-5-6;/h5-9H,1-4H3;2*1-5H3;1-5,7H;/q;;;;+1 SMILES (mnx) [CH3:14][C:19]1=[C:20]([CH3:15])[C:22]([CH3:17])[C:23]([CH3:18])=[C:21]1[CH3:16].[CH3:1][CH:8]([CH3:2])[C+:10]1[CH:6]=[CH:5][CH:7]=[C:11]([CH:9]([CH3:3])[CH3:4])[C:12]1=[N-:13].[CH3:24][C:29]1=[C:30]([CH3:25])[C:32]([CH3:27])[C:33]([CH3:28])=[C:31]1[CH3:26].[CH:34]1=[CH:35][CH:37]=[C:39]([SH:40])[CH:38]=[CH:36]1.[U+:41]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0