PDB CCD ID: | 1TS | ||||||||||||
Number of entries in BioLiP: | 1 | ||||||||||||
Chemical formula: | C32 H34 Cl N7 O6 S | ||||||||||||
InChI: | InChI=1S/C32H34ClN7O6S/c1-46-28-13-12-24(15-25(28)33)47(44,45)39-26(16-29(41)37-18-21-6-4-20(17-34)5-7-21)32(43)40-14-2-3-27(40)31(42)38-19-22-8-10-23(11-9-22)30(35)36/h4-13,15,26-27,39H,2-3,14,16,18-19H2,1H3,(H3,35,36)(H,37,41)(H,38,42)/t26-,27-/m0/s1 | ||||||||||||
InChIKey: | YNEVNNWCKYNFGX-SVBPBHIXSA-N | ||||||||||||
SMILES: |
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Name: | (2S)-N-[(4-carbamimidoylphenyl)methyl]-1-[(2S)-2-[(3-chloro-4-methoxybenzene)sulfonamido]-3-{[(4-cyanophenyl)methyl]carbamoyl}propanoyl]pyrrolidine-2-carboxamide | ||||||||||||
ZINC: | ZINC000098208025 |