(4-methylphenyl)(2-sulfanylidene[1,2,4]triazolo[5,1-b][1,3]benzothiazol-1(2H)-yl)methanone

Properties Image MNX_ID MNXM172485 reference chebi:131328 formula C16H11N3OS2 global charge 0 mol weight 325.418 InChIKey BYHHYJWGZWUAIG-UHFFFAOYSA-N InChI InChI=1S/C16H11N3OS2/c1-10-6-8-11(9-7-10)14(20)19-15(21)17-16-18(19)12-4-2-3-5-13(12)22-16/h2-9H,1H3 SMILES CC1=CC=C(C(=O)N2C(=S)N=C3SC4=C(C=CC=C4)N32)C=C1 MNX internals InChI (mnx) InChI=1/C16H11N3OS2/c1-10-6-8-11(9-7-10)14(20)19-15(21)17-16-18(19)12-4-2-3-5-13(12)22-16/h2-9H,1H3 SMILES (mnx) [CH3:1][C:10]1=[CH:7][CH:9]=[C:11]([C:14]([N:19]2[C:15](=[S:21])[N:17]=[C:16]3[N:18]2[C:12]2=[CH:4][CH:2]=[CH:3][CH:5]=[C:13]2[S:22]3)=[O:20])[CH:8]=[CH:6]1

Parent-child relations graph

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