5-chloranyl-2-fluoranyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate

Systemtic Name: 5-chloranyl-2-fluoranyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-5-chloro-2-fluoro-benzenecarboximidate CAS Name: 5-chloro-2-fluoro-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzenecarboximidate IUPAC Name: 5-chloro-2-fluoro-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-5-chloro-2-fluoro-benzenecarboximidate Formula: C16H12ClFN5OS2- MolecularWeight: 408.880783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(C2=C(C=CC(=C2)Cl)F)[O-])C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(C2=C(C=CC(=C2)Cl)F)[O-])C3=NNC(=S)N3CC=C

InChI

InChI=1S/C16H13ClFN5OS2/c1-3-6-23-13(21-22-16(23)25)12-8(2)19-15(26-12)20-14(24)10-7-9(17)4-5-11(10)18/h3-5,7H,1,6H2,2H3,(H,22,25)(H,19,20,24)/p-1