(3E)-3-[[3-(3-methyl-4-propan-2-yloxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-prop-2-enoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C
33
H
29
N
5
O
3
S
InChI:
InChI=1/C33H29N5O3S/c1-5-17-40-27-14-11-23(12-15-27)31-34-33-38(36-31)32(39)29(42-33)19-25-20-37(26-9-7-6-8-10-26)35-30(25)24-13-16-28(22(4)18-24)41-21(2)3/h5-16,18-21H,1,17H2,2-4H3/b29-19+
InChIKey:
InChIKey=GYAJHKWUAKXIPZ-VUTHCHCSBN
SMILES:
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)OCC=C)S3)C6=CC=CC=C6)OC(C)C
Names:
(3E)-3-[[3-(3-methyl-4-propan-2-yloxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-(4-prop-2-enoxyphenyl)-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 6318740
PubChem ID 11598693
