[4-[(2-imino-4-oxo-8-pyridin-3-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-3-ylidene)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
Molecular Formula:
C
25
H
16
FN
5
O
4
S
InChI:
InChI=1/C25H16FN5O4S/c1-34-20-12-14(8-9-19(20)35-24(33)16-6-2-3-7-18(16)26)11-17-21(27)31-25(29-22(17)32)36-23(30-31)15-5-4-10-28-13-15/h2-13,27H,1H3/b17-11u,27-21+
InChIKey:
InChIKey=YCACJQXUFANWHH-CTYKSHNCBV
SMILES:
COC1=C(C=CC(=C1)C=C2C(=N)N3C(=NC2=O)SC(=N3)C4=CN=CC=C4)OC(=O)C5=CC=CC=C5F
Names:
[4-[(2-imino-4-oxo-8-pyridin-3-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-3-ylidene)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
Registries:
PubChem CID 3565355
PubChem ID 4827292