(3E)-3-[(2,5-dimethyl-1-phenyl-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
23
H
25
N
5
OS
InChI:
InChI=1/C23H25N5OS/c1-5-16(6-2)22-26-28-20(24)19(21(29)25-23(28)30-22)13-17-12-14(3)27(15(17)4)18-10-8-7-9-11-18/h7-13,16,24H,5-6H2,1-4H3/b19-13+,24-20-
InChIKey:
InChIKey=SCVIWQUASSJENJ-RHUMIXQQBX
SMILES:
CCC(CC)C1=NN2C(=N)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)C(=O)N=C2S1
Names:
(3E)-3-[(2,5-dimethyl-1-phenyl-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 6387024
PubChem ID 11609153