2-(2-fluorophenyl)sulfanylethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetate CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetate Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C15H16FN3O4S MolecularWeight: 353.368643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OCCSC2=CC=CC=C2F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OCCSC2=CC=CC=C2F)C)[N+](=O)[O-]

InChI

InChI=1S/C15H16FN3O4S/c1-10-15(19(21)22)11(2)18(17-10)9-14(20)23-7-8-24-13-6-4-3-5-12(13)16/h3-6H,7-9H2,1-2H3