3-[5-[(Z)-(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-furyl]benzoic acid
Molecular Formula:
C
22
H
13
N
5
O
4
S
InChI:
InChI=1/C22H13N5O4S/c23-18-16(10-15-6-7-17(31-15)12-3-1-4-13(9-12)21(29)30)19(28)25-22-27(18)26-20(32-22)14-5-2-8-24-11-14/h1-11,23H,(H,29,30)/b16-10-,23-18-/f/h29H
InChIKey:
InChIKey=UXCPOTLZYBYXAI-XKIKOKTFDW
SMILES:
C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)C=C3C(=N)N4C(=NC3=O)SC(=N4)C5=CN=CC=C5
Names:
3-[5-[(Z)-(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-furyl]benzoic acid
Registries:
PubChem CID 2065247
PubChem ID 11552125