58765-21-2
CICLOTIZOLAM
Name
CICLOTIZOLAM
Formula
C20 H18 Br Cl N4 S
MolWeight
461.813
1Identification
【Name】
CICLOTIZOLAM
【CAS】
【MDL】
MFCD00868172
【English Synonyms】
【Formula】
C20 H18 Br Cl N4 S
【MolWeight】
461.813
【Inchi】
InChI=1S/C20H18BrClN4S/c21-16-10-14-18(13-8-4-5-9-15(13)22)23-11-17-24-25-19(26(17)20(14)27-16)12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2
【InChIKey】
InChIKey=ZOSHXIXUCKESEG-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C2=NCc3nnc(n3-c4c2cc(s4)Br)C5CCCCC5)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CICLOTIZOLAM.cml
Quick Release
17-AAG
75747-14-7
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