2-(N-[2-(Benzimidazol-1-yl)acetyl]-3-fluoroanilino)-N-cyclohexyl-2-(2-methylphenyl)acetamide

Properties Image MNX_ID MNXM819793 reference sabiorkM:31299 formula C30H31FN4O2 global charge 0 mol weight 498.602 InChIKey DXYIOARJXVTYJW-UHFFFAOYSA-N InChI InChI=1S/C30H31FN4O2/c1-21-10-5-6-15-25(21)29(30(37)33-23-12-3-2-4-13-23)35(24-14-9-11-22(31)18-24)28(36)19-34-20-32-26-16-7-8-17-27(26)34/h5-11,14-18,20,23,29H,2-4,12-13,19H2,1H3,(H,33,37) SMILES CC1=CC=CC=C1C(C(O)=NC1CCCCC1)N(C(=O)CN1C=NC2=CC=CC=C21)C1=CC=CC(F)=C1 MNX internals InChI (mnx) InChI=1/C30H31FN4O2/c1-21-10-5-6-15-25(21)29(30(37)33-23-12-3-2-4-13-23)35(24-14-9-11-22(31)18-24)28(36)19-34-20-32-26-16-7-8-17-27(26)34/h5-11,14-18,20,23,29H,2-4,12-13,19H2,1H3,(H,33,37)/t29? SMILES (mnx) [CH3:1][C:21]1=[CH:10][CH:5]=[CH:6][CH:15]=[C:25]1[CH:29]([C:30](=[N:33][CH:23]1[CH2:12][CH2:3][CH2:2][CH2:4][CH2:13]1)[OH:37])[N:35]([C:24]1=[CH:14][CH:9]=[CH:11][C:22]([F:31])=[CH:18]1)[C:28]([CH2:19][N:34]1[CH:20]=[N:32][C:26]2=[CH:16][CH:7]=[CH:8][CH:17]=[C:27]21)=[O:36]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0