N-octylpyrazole-1-carbothioamide

Systemtic Name: N-octylpyrazole-1-carbothioamide Openeye Name: N-octylpyrazole-1-carbothioamide CAS Name: N-octyl-1-pyrazolecarbothioamide IUPAC Name: N-octylpyrazole-1-carbothioamide Traditional Name: N-octylpyrazole-1-carbothioamide Formula: C12H21N3S MolecularWeight: 239.38024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=S)N1C=CC=N1

Isomeric SMILES

CCCCCCCCNC(=S)N1C=CC=N1

InChI

InChI=1S/C12H21N3S/c1-2-3-4-5-6-7-9-13-12(16)15-11-8-10-14-15/h8,10-11H,2-7,9H2,1H3,(H,13,16)