3-[3,4-dihydro-1H-isoquinolin-2-yl-(4-nitrophenyl)methyl]-7-methyl-4-thia-1,6,8-triazabicyclo[3.3.0]octa-2,5,7-trien-2-ol
Molecular Formula:
C
21
H
19
N
5
O
3
S
InChI:
InChI=1/C21H19N5O3S/c1-13-22-21-25(23-13)20(27)19(30-21)18(15-6-8-17(9-7-15)26(28)29)24-11-10-14-4-2-3-5-16(14)12-24/h2-9,18,27H,10-12H2,1H3
InChIKey:
InChIKey=CAANWBMDPWKXJB-UHFFFAOYAG
SMILES:
CC1=NN2C(=C(SC2=N1)C(C3=CC=C(C=C3)[N+](=O)[O-])N4CCC5=CC=CC=C5C4)O
Names:
3-[3,4-dihydro-1H-isoquinolin-2-yl-(4-nitrophenyl)methyl]-7-methyl-4-thia-1,6,8-triazabicyclo[3.3.0]octa-2,5,7-trien-2-ol
Registries:
PubChem CID 4094458
PubChem ID 6014732