2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl N-(3-pyrazol-1-ylpropyl)carbamate

Systemtic Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl N-(3-pyrazol-1-ylpropyl)carbamate Openeye Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl N-(3-pyrazol-1-ylpropyl)carbamate CAS Name: N-[3-(1-pyrazolyl)propyl]carbamic acid 2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl ester IUPAC Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl N-(3-pyrazol-1-ylpropyl)carbamate Traditional Name: N-(3-pyrazol-1-ylpropyl)carbamic acid 2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethyl ester Formula: C15H17F3N4O2S MolecularWeight: 374.38129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CCCNC(=O)OCCSC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CN(N=C1)CCCNC(=O)OCCSC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H17F3N4O2S/c16-15(17,18)12-3-4-13(20-11-12)25-10-9-24-14(23)19-5-1-7-22-8-2-6-21-22/h2-4,6,8,11H,1,5,7,9-10H2,(H,19,23)