2-octan-2-yloxypyridine-3-carbothioamide

Systemtic Name: 2-octan-2-yloxypyridine-3-carbothioamide Openeye Name: 2-(1-methylheptoxy)pyridine-3-carbothioamide CAS Name: 2-octan-2-yloxy-3-pyridinecarbothioamide IUPAC Name: 2-octan-2-yloxypyridine-3-carbothioamide Traditional Name: 2-(1-methylheptoxy)thionicotinamide Formula: C14H22N2OS MolecularWeight: 266.40228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C=CC=N1)C(=S)N

Isomeric SMILES

CCCCCCC(C)OC1=C(C=CC=N1)C(=S)N

InChI

InChI=1S/C14H22N2OS/c1-3-4-5-6-8-11(2)17-14-12(13(15)18)9-7-10-16-14/h7,9-11H,3-6,8H2,1-2H3,(H2,15,18)