(3E)-3-[[1-(4-ethoxyphenyl)-2,5-dimethyl-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
25
H
29
N
5
O
2
S
InChI:
InChI=1/C25H29N5O2S/c1-6-17(7-2)24-28-30-22(26)21(23(31)27-25(30)33-24)14-18-13-15(4)29(16(18)5)19-9-11-20(12-10-19)32-8-3/h9-14,17,26H,6-8H2,1-5H3/b21-14+,26-22-
InChIKey:
InChIKey=RYXPRYZVENJJBD-RUXPXOEYBP
SMILES:
CCC(CC)C1=NN2C(=N)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)OCC)C)C(=O)N=C2S1
Names:
(3E)-3-[[1-(4-ethoxyphenyl)-2,5-dimethyl-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 6372010
PubChem ID 11603741