Base information

Cat. No.
CAS No.6363-02-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C11H11N3O2S
Molecular Weight 249.289
Exact Mass 249.057
XLogP3 1.951
Mr 76.643
PSA 86.72
Sequence -
Atom number 28
Bond number 30
Ring number 3
Rotor number 2
Residues number 0
Canonical smiles [O-][N+](=O)c1cccc(c1)C1N=C2N(C1)CCS2

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