N-butyl-N-pyridin-2-yl-thiolane-2-carbothioamide

Systemtic Name: N-butyl-N-pyridin-2-yl-thiolane-2-carbothioamide Openeye Name: N-butyl-N-(2-pyridyl)tetrahydrothiophene-2-carbothioamide CAS Name: N-butyl-N-(2-pyridinyl)-2-thiolanecarbothioamide IUPAC Name: N-butyl-N-pyridin-2-ylthiolane-2-carbothioamide Traditional Name: N-butyl-N-(2-pyridyl)tetrahydrothiophene-2-carbothioamide Formula: C14H20N2S2 MolecularWeight: 280.452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=N1)C(=S)C2CCCS2

Isomeric SMILES

CCCCN(C1=CC=CC=N1)C(=S)C2CCCS2

InChI

InChI=1S/C14H20N2S2/c1-2-3-10-16(13-8-4-5-9-15-13)14(17)12-7-6-11-18-12/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3