N-heptyl-2-sulfanylidene-1H-pyridine-3-carbothioamide

Systemtic Name: N-heptyl-2-sulfanylidene-1H-pyridine-3-carbothioamide Openeye Name: N-heptyl-2-thioxo-1H-pyridine-3-carbothioamide CAS Name: N-heptyl-2-sulfanylidene-1H-pyridine-3-carbothioamide IUPAC Name: N-heptyl-2-sulfanylidene-1H-pyridine-3-carbothioamide Traditional Name: N-heptyl-2-thioxo-1H-pyridine-3-carbothioamide Formula: C13H20N2S2 MolecularWeight: 268.4413

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)C1=CC=CNC1=S

Isomeric SMILES

CCCCCCCNC(=S)C1=CC=CNC1=S

InChI

InChI=1S/C13H20N2S2/c1-2-3-4-5-6-9-14-12(16)11-8-7-10-15-13(11)17/h7-8,10H,2-6,9H2,1H3,(H,14,16)(H,15,17)