(3Z)-3-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-imino-8-(phenoxymethyl)-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Molecular Formula:
C
27
H
25
N
5
O
2
S
InChI:
InChI=1/C27H25N5O2S/c1-16-9-8-10-17(2)24(16)31-18(3)13-20(19(31)4)14-22-25(28)32-27(29-26(22)33)35-23(30-32)15-34-21-11-6-5-7-12-21/h5-14,28H,15H2,1-4H3/b22-14-,28-25-
InChIKey:
InChIKey=MMYKMRJEBZUJRJ-OUGGDVFGBI
SMILES:
CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)C=C3C(=N)N4C(=NC3=O)SC(=N4)COC5=CC=CC=C5)C
Names:
(3Z)-3-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-imino-8-(phenoxymethyl)-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Registries:
PubChem CID 6367702
PubChem ID 11602234
