ethyl 4-[(3-benzyl-4,8-dimethyl-7-phenyl-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-2-yl)sulfanyl]-3-oxo-butanoate
Molecular Formula:
C
27
H
27
N
3
O
3
S
InChI:
InChI=1/C27H27N3O3S/c1-4-33-24(32)16-22(31)17-34-27-23(15-20-11-7-5-8-12-20)18(2)28-26-25(19(3)29-30(26)27)21-13-9-6-10-14-21/h5-14H,4,15-17H2,1-3H3
InChIKey:
InChIKey=BSKXSQKBPLJYOH-UHFFFAOYAM
SMILES:
CCOC(=O)CC(=O)CSC1=C(C(=NC2=C(C(=NN21)C)C3=CC=CC=C3)C)CC4=CC=CC=C4
Names:
ethyl 4-[(3-benzyl-4,8-dimethyl-7-phenyl-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-2-yl)sulfanyl]-3-oxo-butanoate
Registries:
PubChem CID 3640072
PubChem ID 9823924