[4-[(E)-(2-imino-4-oxo-8-propyl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-3-ylidene)methyl]phenyl] 4-tert-butylbenzoate
Molecular Formula:
C
26
H
26
N
4
O
3
S
InChI:
InChI=1/C26H26N4O3S/c1-5-6-21-29-30-22(27)20(23(31)28-25(30)34-21)15-16-7-13-19(14-8-16)33-24(32)17-9-11-18(12-10-17)26(2,3)4/h7-15,27H,5-6H2,1-4H3/b20-15+,27-22-
InChIKey:
InChIKey=FUFNMDNNOQODPQ-VIZCDRHWBB
SMILES:
CCCC1=NN2C(=N)C(=CC3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C(C)(C)C)C(=O)N=C2S1
Names:
[4-[(E)-(2-imino-4-oxo-8-propyl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-3-ylidene)methyl]phenyl] 4-tert-butylbenzoate
Registries:
PubChem CID 6393437
PubChem ID 11611384