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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)C1(CCCS1)C2=CC=CC=N2

Isomeric SMILES

CCCCCCCNC(=S)C1(CCCS1)C2=CC=CC=N2

InChI

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