DAP1_021128

Molecular Formula: C42H36Cl2N4O5S


InChI: InChI=1/C42H36Cl2N4O5S/c1-19-6-9-24(16-30(19)44)47-38(50)26-11-10-25-28(35(26)40(47)52)17-29-39(51)48(41(53)42(29,4)36(25)22-7-12-32(49)20(2)14-22)34-18-31(45-46(34)5)37-21(3)27-15-23(43)8-13-33(27)54-37/h6-10,12-16,18,26,28-29,35-36,49H,11,17H2,1-5H3/t26-,28+,29-,35-,36-,42+/m0/s1

InChIKey: InChIKey=UIHSDSOVNDBJFK-CYEBDOGZBR
SMILES: CC1=C(C=C(C=C1)N2C(=O)C3CC=C4C(C3C2=O)CC5C(=O)N(C(=O)C5(C4C6=CC(=C(C=C6)O)C)C)C7=CC(=NN7C)C8=C(C9=C(S8)C=CC(=C9)Cl)C)Cl

Names:
    DAP1_021128

Registries:
    PubChem CID 6658073
    PubChem ID 11275962