3-methyl-2-butenoylpyrrothine

Properties Image MNX_ID MNXM161028 reference chebi:224761 formula C11H12N2O2S2 global charge 0 mol weight 268.363 InChIKey JFEBCAJATWCFMT-UHFFFAOYSA-N InChI InChI=1S/C11H12N2O2S2/c1-6(2)4-8(14)12-9-10-7(5-16-17-10)13(3)11(9)15/h4-5H,1-3H3,(H,12,14) SMILES CC(C)=CC(=O)NC1=C2SSC=C2N(C)C1=O MNX internals InChI (mnx) InChI=1/C11H12N2O2S2/c1-6(2)4-8(14)12-9-10-7(5-16-17-10)13(3)11(9)15/h4-5H,1-3H3,(H,12,14) SMILES (mnx) [CH3:1][C:6]([CH3:2])=[CH:4][C:8](=[N:12][C:9]1=[C:10]2[C:7](=[CH:5][S:16][S:17]2)[N:13]([CH3:3])[C:11]1=[O:15])[OH:14]

Parent-child relations graph

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