N-heptyl-N-pyridin-2-yl-thiolane-2-carbothioamide

Systemtic Name: N-heptyl-N-pyridin-2-yl-thiolane-2-carbothioamide Openeye Name: N-heptyl-N-(2-pyridyl)tetrahydrothiophene-2-carbothioamide CAS Name: N-heptyl-N-(2-pyridinyl)-2-thiolanecarbothioamide IUPAC Name: N-heptyl-N-pyridin-2-ylthiolane-2-carbothioamide Traditional Name: N-heptyl-N-(2-pyridyl)tetrahydrothiophene-2-carbothioamide Formula: C17H26N2S2 MolecularWeight: 322.53174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2S2/c1-2-3-4-5-8-13-19(16-11-6-7-12-18-16)17(20)15-10-9-14-21-15/h6-7,11-12,15H,2-5,8-10,13-14H2,1H3