(3E)-2-imino-9-(2-methylpropylsulfonyl)-3-[(7-phenyl-4-thia-1,6-diazabicyclo[3.3.0]octa-2,5,7-trien-8-yl)methylidene]-7-thia-1,5,8-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Molecular Formula:
C21H18N6O3S3
InChI: InChI=1/C21H18N6O3S3/c1-12(2)11-33(29,30)21-25-32-20-24-18(28)14(17(22)27(20)21)10-15-16(13-6-4-3-5-7-13)23-19-26(15)8-9-31-19/h3-10,12,22H,11H2,1-2H3/b14-10+,22-17-
InChIKey: InChIKey=GRKYRTJHFOPTPQ-WAEYBMNLBE
SMILES: CC(C)CS(=O)(=O)C1=NSC2=NC(=O)C(=CC3=C(N=C4N3C=CS4)C5=CC=CC=C5)C(=N)N21
Names:
(3E)-2-imino-9-(2-methylpropylsulfonyl)-3-[(7-phenyl-4-thia-1,6-diazabicyclo[3.3.0]octa-2,5,7-trien-8-yl)methylidene]-7-thia-1,5,8-triazabicyclo[4.3.0]nona-5,8-dien-4-one
Registries:
PubChem CID 6389148
PubChem ID 11609998
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