[[4-ethoxycarbonyl-2-(4-methyl-8-phenyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)pyrazol-3-yl]amino]methylidene-dimethyl-azanium
Molecular Formula:
C
22
H
23
N
6
O
2
S
+
InChI:
InChI=1/C22H22N6O2S/c1-5-30-22(29)17-12-24-28(19(17)23-13-27(3)4)20-16-11-18(15-9-7-6-8-10-15)31-21(16)26-14(2)25-20/h6-13H,5H2,1-4H3/p+1/fC22H23N6O2S/h23H/q+1
InChIKey:
InChIKey=JPGMBCNLILOVCK-WPMYHQFCCN
SMILES:
CCOC(=O)C1=C(N(N=C1)C2=C3C=C(SC3=NC(=N2)C)C4=CC=CC=C4)NC=[N+](C)C
Names:
[[4-ethoxycarbonyl-2-(4-methyl-8-phenyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)pyrazol-3-yl]amino]methylidene-dimethyl-azanium
Registries:
PubChem CID 3576304
PubChem ID 4847863