(3Z)-8-benzylsulfanyl-3-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-imino-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Molecular Formula:
C
27
H
25
N
5
OS
2
InChI:
InChI=1/C27H25N5OS2/c1-4-19-10-12-22(13-11-19)31-17(2)14-21(18(31)3)15-23-24(28)32-26(29-25(23)33)35-27(30-32)34-16-20-8-6-5-7-9-20/h5-15,28H,4,16H2,1-3H3/b23-15-,28-24-
InChIKey:
InChIKey=QXTPDOBCUFXTSA-IQGIQZAKBD
SMILES:
CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=N)N4C(=NC3=O)SC(=N4)SCC5=CC=CC=C5)C
Names:
(3Z)-8-benzylsulfanyl-3-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-imino-7-thia-1,5,9-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Registries:
PubChem CID 6372816
PubChem ID 11604046