AURORA 4681

CAS No.
CCD No.
CCD00270037
Formula
C17H9N5O5S2
MolWeight
427.42

Basic Information

Product Name: AURORA 4681
English Synonyms: AURORA 4681
MDL Number.: MFCD01911977
H bond acceptor: 10
H bond donor: 2
Smile: [O-][N+](=O)C1=CC2=C(NC(=O)\C2=C2/SC(=S)N(NC(=O)C3=CN=CC=C3)C2=O)C=C1
InChi: InChI=1S/C17H9N5O5S2/c23-14(8-2-1-5-18-7-8)20-21-16(25)13(29-17(21)28)12-10-6-9(22(26)27)3-4-11(10)19-15(12)24/h1-7H,(H,19,24)(H,20,23)/b13-12-
InChiKey: InChIKey=HNYOSXJYDRLFAL-SEYXRHQNSA-N

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