PDB CCD ID: | YSX | ||||||||||
Number of entries in BioLiP: | 1 | ||||||||||
Chemical formula: | C25 H27 F N4 O6 S | ||||||||||
InChI: | InChI=1S/C25H27FN4O6S/c1-14(30-20(31)12-29(25(30)34)10-4-9-27)17-5-3-6-18-21(23(24(32)33)28-22(17)18)15-7-8-16(19(26)11-15)13-37(2,35)36/h3,5-8,11,14,28H,4,9-10,12-13,27H2,1-2H3,(H,32,33)/t14-/m0/s1 | ||||||||||
InChIKey: | XOMHMYMNGWYVNR-AWEZNQCLSA-N | ||||||||||
SMILES: |
| ||||||||||
Name: | 7-[(1~{S})-1-[3-(3-azanylpropyl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethyl]-3-[3-fluoranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid |