Base information

Cat. No.
CAS No.80680-05-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C11H13N5O2S
Molecular Weight 279.318
Exact Mass 279.079
XLogP3 2.8259
Mr 75.728
PSA 117.66
Sequence -
Atom number 32
Bond number 33
Ring number 2
Rotor number 4
Residues number 0
Canonical smiles CCc1nnc(s1)/C(=C/c1ncc(n1C)[N+](=O)[O-])/C

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