methyl 2-[4-amino-3-benzyl-2,6-dioxo-5-[2-(1,7,8-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-ylsulfanyl)acetyl]pyrimidin-1-yl]acetate
Molecular Formula:
C
22
H
20
N
6
O
5
S
InChI:
InChI=1/C22H20N6O5S/c1-33-17(30)12-28-20(31)18(19(23)27(22(28)32)11-14-7-3-2-4-8-14)15(29)13-34-21-25-24-16-9-5-6-10-26(16)21/h2-10H,11-13,23H2,1H3
InChIKey:
InChIKey=JRJTVGQKGJMDQU-UHFFFAOYAK
SMILES:
COC(=O)CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CSC3=NN=C4N3C=CC=C4
Names:
methyl 2-[4-amino-3-benzyl-2,6-dioxo-5-[2-(1,7,8-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-ylsulfanyl)acetyl]pyrimidin-1-yl]acetate
Registries:
PubChem CID 4844207
PubChem ID 9801181