2-heptoxypyridine-4-carbothioamide

Systemtic Name: 2-heptoxypyridine-4-carbothioamide Openeye Name: 2-heptoxypyridine-4-carbothioamide CAS Name: 2-heptoxy-4-pyridinecarbothioamide IUPAC Name: 2-heptoxypyridine-4-carbothioamide Traditional Name: 2-heptoxythioisonicotinamide Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=NC=CC(=C1)C(=S)N

Isomeric SMILES

CCCCCCCOC1=NC=CC(=C1)C(=S)N

InChI

InChI=1S/C13H20N2OS/c1-2-3-4-5-6-9-16-12-10-11(13(14)17)7-8-15-12/h7-8,10H,2-6,9H2,1H3,(H2,14,17)