N-dodecyl-2-pyridin-2-yl-thiolane-2-carbothioamide

Systemtic Name: N-dodecyl-2-pyridin-2-yl-thiolane-2-carbothioamide Openeye Name: N-dodecyl-2-(2-pyridyl)tetrahydrothiophene-2-carbothioamide CAS Name: N-dodecyl-2-(2-pyridinyl)-2-thiolanecarbothioamide IUPAC Name: N-dodecyl-2-pyridin-2-ylthiolane-2-carbothioamide Traditional Name: N-lauryl-2-(2-pyridyl)tetrahydrothiophene-2-carbothioamide Formula: C22H36N2S2 MolecularWeight: 392.66464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2S2/c1-2-3-4-5-6-7-8-9-10-12-18-24-21(25)22(16-14-19-26-22)20-15-11-13-17-23-20/h11,13,15,17H,2-10,12,14,16,18-19H2,1H3,(H,24,25)