3-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C12H9ClFN4O2S- MolecularWeight: 327.741863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NC2=CC(=C(C=C2)F)Cl)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NC2=CC(=C(C=C2)F)Cl)[O-]

InChI

InChI=1S/C12H10ClFN4O2S/c1-6-11(20)16-12(18-17-6)21-5-10(19)15-7-2-3-9(14)8(13)4-7/h2-4H,5H2,1H3,(H,15,19)(H,16,18,20)/p-1