1-[5-[2-(tert-butylamino)-4H-1,3,4-thiadiazin-5-ylidene]-2,4-dimethyl-3-pyrrolyl]ethanone

Properties Image MNX_ID MNXM341113 reference chebi:121901 formula C15H22N4OS global charge 0 mol weight 306.435 InChIKey XHDPLVKOCUSBPS-UHFFFAOYSA-N InChI InChI=1S/C15H22N4OS/c1-8-12(10(3)20)9(2)16-13(8)11-7-21-14(19-18-11)17-15(4,5)6/h18H,7H2,1-6H3,(H,17,19) SMILES CC(=O)C1=C(C)C(=C2CSC(NC(C)(C)C)=NN2)N=C1C MNX internals InChI (mnx) InChI=1/C15H22N4OS/c1-8-12(10(3)20)9(2)16-13(8)11-7-21-14(19-18-11)17-15(4,5)6/h18H,7H2,1-6H3,(H,17,19)/b13-11? SMILES (mnx) [CH3:1][C:8]1=[C:12]([C:10]([CH3:3])=[O:20])[C:9]([CH3:2])=[N:16][C:13]1=[C:11]1[CH2:7][S:21][C:14](=[N:17][C:15]([CH3:4])([CH3:5])[CH3:6])[NH:19][NH:18]1

Parent-child relations graph

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