N-(2-fluoranyl-5-nitro-phenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-fluoranyl-5-nitro-phenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-fluoro-5-nitro-phenyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-fluoro-5-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-fluoro-5-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-fluoro-5-nitro-phenyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H17FN6O3S MolecularWeight: 416.429383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C3=CC=NC=C3

InChI

InChI=1S/C18H17FN6O3S/c1-2-9-24-17(12-5-7-20-8-6-12)22-23-18(24)29-11-16(26)21-15-10-13(25(27)28)3-4-14(15)19/h3-8,10H,2,9,11H2,1H3,(H,21,26)