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

Systemtic Name: 6-methyl-3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 6-methyl-3-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 6-methyl-3-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[(2-cumidino-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O2S/c1-9(2)11-4-6-12(7-5-11)16-13(20)8-22-15-17-14(21)10(3)18-19-15/h4-7,9H,8H2,1-3H3,(H,16,20)(H,17,19,21)/p-1