6-(3-oxidanylpropoxy)pyridine-3-carbothioamide

Systemtic Name: 6-(3-oxidanylpropoxy)pyridine-3-carbothioamide Openeye Name: 6-(3-hydroxypropoxy)pyridine-3-carbothioamide CAS Name: 6-(3-hydroxypropoxy)-3-pyridinecarbothioamide IUPAC Name: 6-(3-hydroxypropoxy)pyridine-3-carbothioamide Traditional Name: 6-(3-hydroxypropoxy)thionicotinamide Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(=S)N)OCCCO

Isomeric SMILES

C1=CC(=NC=C1C(=S)N)OCCCO

InChI

InChI=1S/C9H12N2O2S/c10-9(14)7-2-3-8(11-6-7)13-5-1-4-12/h2-3,6,12H,1,4-5H2,(H2,10,14)