3-benzyl-8-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Molecular Formula:
C
33
H
29
N
5
O
3
S
InChI:
InChI=1/C33H29N5O3S/c1-21(2)20-41-28-15-14-24(16-22(28)3)30-25(19-37(36-30)26-12-8-5-9-13-26)18-29-32(40)38-33(42-29)34-31(39)27(35-38)17-23-10-6-4-7-11-23/h4-16,18-19,21H,17,20H2,1-3H3
InChIKey:
InChIKey=MHNWQJWZTUTJDC-UHFFFAOYAN
SMILES:
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=CC=C5)S3)C6=CC=CC=C6)OCC(C)C
Names:
3-benzyl-8-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-7-thia-1,2,5-triazabicyclo[4.3.0]nona-2,5-diene-4,9-dione
Registries:
PubChem CID 4507832
PubChem ID 6632366