ZINC04785829
Molecular Formula:
C17H16N4O5S
InChI: InChI=1/C17H16N4O5S/c1-8-11(16(23)26-2)12(9-5-4-6-10(7-9)21(24)25)13-14(18-8)19-17(27-3)20-15(13)22/h4-7,12H,1-3H3,(H2,18,19,20,22)/t12-/m1/s1/f/h18-19H
InChIKey: InChIKey=JUPGDQIYNNIOCR-RCQAOHQHDJ
SMILES: CC1=C(C(C2=C(N1)NC(=NC2=O)SC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC
Names:
methyl (10S)-8-methyl-4-methylsulfanyl-10-(3-nitrophenyl)-2-oxo-3,5,7-triazabicyclo[4.4.0]deca-3,8,11-triene-9-carboxylate
ZINC04785829
Registries:
PubChem CID 7358483
PubChem ID 12574779
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