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

Systemtic Name: 3-[2-[ethyl-(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(N-ethyl-3-methyl-anilino)-2-oxo-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(N-ethyl-3-methylanilino)-2-oxoethyl]thio]-6-phenyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(N-ethyl-3-methyl-anilino)-2-keto-ethyl]thio]-6-phenyl-1,2,4-triazin-5-olate Formula: C20H19N4O2S- MolecularWeight: 379.45546

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H20N4O2S/c1-3-24(16-11-7-8-14(2)12-16)17(25)13-27-20-21-19(26)18(22-23-20)15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3,(H,21,23,26)/p-1