InChIKey | KELMVSJFGCWRLO-MLMVTELGSA-N |
---|---|
Inchi | 1S/C47H69ClN12O9S2/c1-5-59(6-2)45(68)31(12-7-19-52-47(50)51)54-43(66)36-13-8-20-60(36)46(69)35-26-70-21-10-14-38(62)53-32(23-28-15-17-29(48)18-16-28)40(63)55-33(24-30-11-9-22-71-30)42(65)58-39(27(3)4)44(67)56-34(25-37(49)61)41(64)57-35/h9,11,15-18,22,27,31-36,39H,5-8,10,12-14,19-21,23-26H2,1-4H3,(H2,49,61)(H,53,62)(H,54,66)(H,55,63)(H,56,67)(H,57,64)(H,58,65)(H4,50,51,52)/t31-,32+,33+,34+,35+,36+,39+/m1/s1 |
SMILES | C([C@@H]1CSCCCC(N[C@H](C(=O)N[C@@H](CC2SC=CC=2)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N1)CC1C=CC(Cl)=CC=1)=O)(N1CCC[C@H]1C(=O)N[C@H](CCCNC(N)=N)C(=O)N(CC)CC)=O |