3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[(2-keto-2-p-phenetyl-ethyl)thio]-6-methyl-1,2,4-triazin-5-olate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CSC2=NC(=C(N=N2)C)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CSC2=NC(=C(N=N2)C)[O-]

InChI

InChI=1S/C14H15N3O3S/c1-3-20-11-6-4-10(5-7-11)12(18)8-21-14-15-13(19)9(2)16-17-14/h4-7H,3,8H2,1-2H3,(H,15,17,19)/p-1