Base information

Cat. No.
CAS No.64038-64-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C6H8N2O2S
Molecular Weight 172.205
Exact Mass 172.031
XLogP3 1.249
Mr 42.0639
PSA 89.97
Sequence -
Atom number 19
Bond number 19
Ring number 1
Rotor number 3
Residues number 0
Canonical smiles CCOC(=O)c1c[nH]c(=S)[nH]1

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