(3E)-3-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylidene]-2-imino-8-pentan-3-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Molecular Formula:
C
24
H
27
N
5
OS
InChI:
InChI=1/C24H27N5OS/c1-6-17(7-2)23-27-29-21(25)20(22(30)26-24(29)31-23)13-18-12-15(4)28(16(18)5)19-10-8-9-14(3)11-19/h8-13,17,25H,6-7H2,1-5H3/b20-13+,25-21-
InChIKey:
InChIKey=GLISAZSLBRIEOQ-DDNGPHSTBJ
SMILES:
CCC(CC)C1=NN2C(=N)C(=CC3=C(N(C(=C3)C)C4=CC=CC(=C4)C)C)C(=O)N=C2S1
Names:
(3E)-3-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylidene]-2-imino-8-pentan-3-yl-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Registries:
PubChem CID 6300247
PubChem ID 11593769