7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
29
H
21
N
5
O
3
S
InChI:
InChI=1/C29H21N5O3S/c1-18-11-13-19(14-12-18)26-20(16-33(31-26)21-7-3-2-4-8-21)15-25-28(35)34-29(38-25)30-27(32-34)24-17-36-22-9-5-6-10-23(22)37-24/h2-16,24H,17H2,1H3
InChIKey:
InChIKey=BFNMROBMDSHDLY-UHFFFAOYAE
SMILES:
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5COC6=CC=CC=C6O5)S3)C7=CC=CC=C7
Names:
7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4504010
PubChem ID 6628005