Omeprazole sulfone

Properties Image MNX_ID MNXM128867 reference chebi:166518 formula C17H19N3O4S global charge 0 mol weight 361.423 InChIKey IXEQEYRTSRFZEO-UHFFFAOYSA-N InChI InChI=1S/C17H19N3O4S/c1-10-8-18-15(11(2)16(10)24-4)9-25(21,22)17-19-13-6-5-12(23-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20) SMILES COC1=CC2=C(C=C1)N=C(S(=O)(=O)CC1=NC=C(C)C(OC)=C1C)N2 MNX internals InChI (mnx) InChI=1/C17H19N3O4S/c1-10-8-18-15(11(2)16(10)24-4)9-25(21,22)17-19-13-6-5-12(23-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20) SMILES (mnx) [CH3:1][C:10]1=[CH:8][N:18]=[C:15]([CH2:9][S:25]([C:17]2=[N:19][C:13]3=[C:14]([CH:7]=[C:12]([O:23][CH3:3])[CH:5]=[CH:6]3)[NH:20]2)(=[O:21])=[O:22])[C:11]([CH3:2])=[C:16]1[O:24][CH3:4]

Parent-child relations graph

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