Apricoxib (USAN/INN)

Properties Image MNX_ID MNXM42445 reference keggD:D08657 formula C19H20N2O3S global charge 0 mol weight 356.447 InChIKey JTMITOKKUMVWRT-UHFFFAOYSA-N InChI InChI=1S/C19H20N2O3S/c1-3-24-17-8-4-15(5-9-17)19-12-14(2)13-21(19)16-6-10-18(11-7-16)25(20,22)23/h4-13H,3H2,1-2H3,(H2,20,22,23) SMILES CCOC1=CC=C(C2=CC(C)=CN2C2=CC=C(S(N)(=O)=O)C=C2)C=C1 MNX internals InChI (mnx) InChI=1/C19H20N2O3S/c1-3-24-17-8-4-15(5-9-17)19-12-14(2)13-21(19)16-6-10-18(11-7-16)25(20,22)23/h4-13H,3H2,1-2H3,(H2,20,22,23) SMILES (mnx) [CH3:1][CH2:3][O:24][C:17]1=[CH:9][CH:5]=[C:15]([C:19]2=[CH:12][C:14]([CH3:2])=[CH:13][N:21]2[C:16]2=[CH:7][CH:11]=[C:18]([S:25]([NH2:20])(=[O:22])=[O:23])[CH:10]=[CH:6]2)[CH:4]=[CH:8]1

Parent-child relations graph

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