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

Systemtic Name: 3-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C15H17N4O2S- MolecularWeight: 317.38608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=C(N=N2)C)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=C(N=N2)C)[O-])C

InChI

InChI=1S/C15H18N4O2S/c1-4-11-7-5-6-9(2)13(11)16-12(20)8-22-15-17-14(21)10(3)18-19-15/h5-7H,4,8H2,1-3H3,(H,16,20)(H,17,19,21)/p-1