Stereochemistry | ABSOLUTE |
Molecular Formula | C27H34ClN7OS |
Molecular Weight | 540.123 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1CCN(CCCNC(=O)C[C@@H]2N=C(C3=C(SC(C)=C3C)N4C(C)=NN=C24)C5=CC=C(Cl)C=C5)CC1
InChI
InChIKey=PKQXLRYFPSZKDU-QFIPXVFZSA-N
InChI=1S/C27H34ClN7OS/c1-17-18(2)37-27-24(17)25(20-6-8-21(28)9-7-20)30-22(26-32-31-19(3)35(26)27)16-23(36)29-10-5-11-34-14-12-33(4)13-15-34/h6-9,22H,5,10-16H2,1-4H3,(H,29,36)/t22-/m0/s1