2-decylsulfanylpyridine-4-carbothioamide

Systemtic Name: 2-decylsulfanylpyridine-4-carbothioamide Openeye Name: 2-decylsulfanylpyridine-4-carbothioamide CAS Name: 2-(decylthio)-4-pyridinecarbothioamide IUPAC Name: 2-decylsulfanylpyridine-4-carbothioamide Traditional Name: 2-(decylthio)thioisonicotinamide Formula: C16H26N2S2 MolecularWeight: 310.52104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NC=CC(=C1)C(=S)N

Isomeric SMILES

CCCCCCCCCCSC1=NC=CC(=C1)C(=S)N

InChI

InChI=1S/C16H26N2S2/c1-2-3-4-5-6-7-8-9-12-20-15-13-14(16(17)19)10-11-18-15/h10-11,13H,2-9,12H2,1H3,(H2,17,19)